1,2-Bis[(3,5-diphenyl-1H-pyrazol-1-yl)meth-yl]benzene

Lara C. Spencer; Ilia A. Guzei; Tebogo V. Segapelo; James Darkwa

doi:10.1107/S1600536812032801

1,2-Bis[(3,5-diphenyl-1H-pyrazol-1-yl)meth-yl]benzene

Lara C. Spencer, Ilia A. Guzei, Tebogo V. Segapelo, James Darkwa

Chemical Sciences

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

1 Citation (Scopus)

Abstract

The title compound, C38H30N4, a potentially mono-and bidentate ligand, does not seem to form palladium complexes similar to other poly(pyrazol-1-ylmeth-yl) benzenes due to the large steric size of the phenyl substituents on the pyrazole rings. The pyrazole rings have a 21.09 (5)°angle between their mean planes and exhibit a trans-like geometry in which the in-plane lone pairs of electrons on the 2-N nitrogen atoms point in opposite directions.

Original language	English
Pages (from-to)	o2584
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	68
Issue number	8
DOIs	https://doi.org/10.1107/S1600536812032801
Publication status	Published - Aug 2012

Keywords

R factor = 0.035
T = 100 K
data-to-parameter ratio = 14.1
mean σ(C-C) = 0.002 Å
single-crystal X-ray study
wR factor = 0.094

ASJC Scopus subject areas

General Chemistry
General Materials Science
Condensed Matter Physics

Access to Document

10.1107/S1600536812032801

Cite this

@article{eb27c533f4854ff396be81e9490de9fb,

title = "1,2-Bis[(3,5-diphenyl-1H-pyrazol-1-yl)meth-yl]benzene",

abstract = "The title compound, C38H30N4, a potentially mono-and bidentate ligand, does not seem to form palladium complexes similar to other poly(pyrazol-1-ylmeth-yl) benzenes due to the large steric size of the phenyl substituents on the pyrazole rings. The pyrazole rings have a 21.09 (5)°angle between their mean planes and exhibit a trans-like geometry in which the in-plane lone pairs of electrons on the 2-N nitrogen atoms point in opposite directions.",

keywords = "R factor = 0.035, T = 100 K, data-to-parameter ratio = 14.1, mean σ(C-C) = 0.002 {\AA}, single-crystal X-ray study, wR factor = 0.094",

author = "Spencer, {Lara C.} and Guzei, {Ilia A.} and Segapelo, {Tebogo V.} and James Darkwa",

year = "2012",

month = aug,

doi = "10.1107/S1600536812032801",

language = "English",

volume = "68",

pages = "o2584",

journal = "Acta Crystallographica Section E: Structure Reports Online",

issn = "1600-5368",

number = "8",

}

TY - JOUR

T1 - 1,2-Bis[(3,5-diphenyl-1H-pyrazol-1-yl)meth-yl]benzene

AU - Spencer, Lara C.

AU - Guzei, Ilia A.

AU - Segapelo, Tebogo V.

AU - Darkwa, James

PY - 2012/8

Y1 - 2012/8

N2 - The title compound, C38H30N4, a potentially mono-and bidentate ligand, does not seem to form palladium complexes similar to other poly(pyrazol-1-ylmeth-yl) benzenes due to the large steric size of the phenyl substituents on the pyrazole rings. The pyrazole rings have a 21.09 (5)°angle between their mean planes and exhibit a trans-like geometry in which the in-plane lone pairs of electrons on the 2-N nitrogen atoms point in opposite directions.

AB - The title compound, C38H30N4, a potentially mono-and bidentate ligand, does not seem to form palladium complexes similar to other poly(pyrazol-1-ylmeth-yl) benzenes due to the large steric size of the phenyl substituents on the pyrazole rings. The pyrazole rings have a 21.09 (5)°angle between their mean planes and exhibit a trans-like geometry in which the in-plane lone pairs of electrons on the 2-N nitrogen atoms point in opposite directions.

KW - R factor = 0.035

KW - T = 100 K

KW - data-to-parameter ratio = 14.1

KW - mean σ(C-C) = 0.002 Å

KW - single-crystal X-ray study

KW - wR factor = 0.094

UR - http://www.scopus.com/inward/record.url?scp=84864681424&partnerID=8YFLogxK

U2 - 10.1107/S1600536812032801

DO - 10.1107/S1600536812032801

M3 - Article

AN - SCOPUS:84864681424

SN - 1600-5368

VL - 68

SP - o2584

JO - Acta Crystallographica Section E: Structure Reports Online

JF - Acta Crystallographica Section E: Structure Reports Online

IS - 8

ER -

1,2-Bis[(3,5-diphenyl-1H-pyrazol-1-yl)meth-yl]benzene

Abstract

Keywords

ASJC Scopus subject areas

Access to Document

Other files and links

Fingerprint

Cite this