Dicyclohexylammonium O,O′-diphenyl phosphate, [(C                         
                        6
                                                 H                         
                        11
                                                 )                         
                        2
                                                 NH                         
                        2
                                                 ][(C                         
                        6
                                                 H                         
                        5
                                                 O)                         
                        2
                                                 P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis

Samira Nazari Moghaddam; Akbar Raissi Shabari; Fahimeh Sabbaghi; Mehrdad Pourayoubi; Abdul Ajees Abdul Salam

doi:10.3390/M1051

Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis

Samira Nazari Moghaddam
, Akbar Raissi Shabari^*
, Fahimeh Sabbaghi
, Mehrdad Pourayoubi
, Abdul Ajees Abdul Salam

^*Corresponding author for this work

Manipal Institute of Applied Physics (MIAP)

Research output: Contribution to journal › Article › peer-review

1 Citation (Scopus)

Abstract

The title salt, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)], crystallizes in the chiral space group P2 ₁ 2 ₁ 2 ₁ , composed of achiral cation and anion components. The strong charge-assisted N–H…O hydrogen bonds build a linear assembly along the a axis, including a non-centrosymmetric C ₂ ² (6) chain graph-set motif. The intra and intermolecular C–H…O interactions as well as the C–H…π-electron ring interactions also exist in the crystal structure. Fingerprint plots are used for a detailed investigation of intermolecular interactions participating in the crystal packing. The spectroscopic features (IR, ¹ H NMR, ¹³ C{ ¹ H} NMR, ³¹ P{ ¹ H} NMR, and mass) are studied.

Original language	English
Article number	1051
Journal	MolBank
Volume	2019
Issue number	1
DOIs	https://doi.org/10.3390/M1051
Publication status	Published - 01-03-2019

All Science Journal Classification (ASJC) codes

Biochemistry
Physical and Theoretical Chemistry
Organic Chemistry

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10.3390/M1051

Cite this

Moghaddam, S. N., Shabari, A. R., Sabbaghi, F., Pourayoubi, M., & Salam, A. A. A. (2019). Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis. MolBank, 2019(1), Article 1051. https://doi.org/10.3390/M1051

Moghaddam, Samira Nazari ; Shabari, Akbar Raissi ; Sabbaghi, Fahimeh et al. / Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)] : Spectroscopic study, crystal structure, and hirshfeld surface analysis. In: MolBank. 2019 ; Vol. 2019, No. 1.

@article{7541fa0e38844477b307840f95929ad4,

title = "Dicyclohexylammonium O,O′-diphenyl phosphate, [(C 6 H 11 ) 2 NH 2 ][(C 6 H 5 O) 2 P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis",

abstract = " The title salt, [(C 6 H 11 ) 2 NH 2 ][(C 6 H 5 O) 2 P(O)(O)], crystallizes in the chiral space group P2 1 2 1 2 1 , composed of achiral cation and anion components. The strong charge-assisted N–H…O hydrogen bonds build a linear assembly along the a axis, including a non-centrosymmetric C 2 2 (6) chain graph-set motif. The intra and intermolecular C–H…O interactions as well as the C–H…π-electron ring interactions also exist in the crystal structure. Fingerprint plots are used for a detailed investigation of intermolecular interactions participating in the crystal packing. The spectroscopic features (IR, 1 H NMR, 13 C\{ 1 H\} NMR, 31 P\{ 1 H\} NMR, and mass) are studied. ",

author = "Moghaddam, \{Samira Nazari\} and Shabari, \{Akbar Raissi\} and Fahimeh Sabbaghi and Mehrdad Pourayoubi and Salam, \{Abdul Ajees Abdul\}",

note = "Publisher Copyright: {\textcopyright} 2019 by the authors. Licensee MDPI, Basel, Switzerland.",

year = "2019",

month = mar,

day = "1",

doi = "10.3390/M1051",

language = "English",

volume = "2019",

journal = "MolBank",

issn = "1422-8599",

publisher = "Multidisciplinary Digital Publishing Institute (MDPI)",

number = "1",

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Moghaddam, SN, Shabari, AR, Sabbaghi, F, Pourayoubi, M & Salam, AAA 2019, 'Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis', MolBank, vol. 2019, no. 1, 1051. https://doi.org/10.3390/M1051

Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis. / Moghaddam, Samira Nazari; Shabari, Akbar Raissi; Sabbaghi, Fahimeh et al.
In: MolBank, Vol. 2019, No. 1, 1051, 01.03.2019.

Research output: Contribution to journal › Article › peer-review

TY - JOUR

T1 - Dicyclohexylammonium O,O′-diphenyl phosphate, [(C 6 H 11 ) 2 NH 2 ][(C 6 H 5 O) 2 P(O)(O)]

T2 - Spectroscopic study, crystal structure, and hirshfeld surface analysis

AU - Moghaddam, Samira Nazari

AU - Shabari, Akbar Raissi

AU - Sabbaghi, Fahimeh

AU - Pourayoubi, Mehrdad

AU - Salam, Abdul Ajees Abdul

PY - 2019/3/1

Y1 - 2019/3/1

N2 - The title salt, [(C 6 H 11 ) 2 NH 2 ][(C 6 H 5 O) 2 P(O)(O)], crystallizes in the chiral space group P2 1 2 1 2 1 , composed of achiral cation and anion components. The strong charge-assisted N–H…O hydrogen bonds build a linear assembly along the a axis, including a non-centrosymmetric C 2 2 (6) chain graph-set motif. The intra and intermolecular C–H…O interactions as well as the C–H…π-electron ring interactions also exist in the crystal structure. Fingerprint plots are used for a detailed investigation of intermolecular interactions participating in the crystal packing. The spectroscopic features (IR, 1 H NMR, 13 C{ 1 H} NMR, 31 P{ 1 H} NMR, and mass) are studied.

AB - The title salt, [(C 6 H 11 ) 2 NH 2 ][(C 6 H 5 O) 2 P(O)(O)], crystallizes in the chiral space group P2 1 2 1 2 1 , composed of achiral cation and anion components. The strong charge-assisted N–H…O hydrogen bonds build a linear assembly along the a axis, including a non-centrosymmetric C 2 2 (6) chain graph-set motif. The intra and intermolecular C–H…O interactions as well as the C–H…π-electron ring interactions also exist in the crystal structure. Fingerprint plots are used for a detailed investigation of intermolecular interactions participating in the crystal packing. The spectroscopic features (IR, 1 H NMR, 13 C{ 1 H} NMR, 31 P{ 1 H} NMR, and mass) are studied.

UR - https://www.scopus.com/pages/publications/85064115276

UR - https://www.scopus.com/pages/publications/85064115276#tab=citedBy

U2 - 10.3390/M1051

DO - 10.3390/M1051

M3 - Article

AN - SCOPUS:85064115276

SN - 1422-8599

VL - 2019

JO - MolBank

JF - MolBank

IS - 1

M1 - 1051

ER -

Moghaddam SN, Shabari AR, Sabbaghi F, Pourayoubi M, Salam AAA. Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis. MolBank. 2019 Mar 1;2019(1):1051. doi: 10.3390/M1051

Dicyclohexylammonium O,O′-diphenyl phosphate, [(C 6 H 11 ) 2 NH 2 ][(C 6 H 5 O) 2 P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis

Abstract

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Dicyclohexylammonium O,O′-diphenyl phosphate, [(C ₆ H ₁₁ ) ₂ NH ₂ ][(C ₆ H ₅ O) ₂ P(O)(O)]: Spectroscopic study, crystal structure, and hirshfeld surface analysis