Crystallography Open Database

Information card for entry 7245688

Preview

Coordinates	7245688.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	4-Bromo-2-(4,5-diphenyl-1-phenyl-1H-imidazol-2-yl)phenol
Formula	C27 H19 Br N2 O
Calculated formula	C27 H19 Br N2 O
Title of publication	Synthesis, Antimicrobial Potential and Computational Studies of Crystalline 4-Bromo-2-(1,4,5-triphenyl-1-H-imidazole-2-yl)phenol and its Metal Complexes
Authors of publication	Ali, Akbar; Siddique, Abu Bakar; Ahmad, Saeed; Shaheen, Muhammad Ashraf; Tahir, Muhammad Nawaz; Vieira, Lucas Campos Curcino; Muhammad, Shabbir; Siddeeg, Saifeldin M.
Journal of publication	CrystEngComm
Year of publication	2022
a	12.8119 ± 0.0006 Å
b	17.9369 ± 0.0011 Å
c	19.3259 ± 0.0011 Å
α	90°
β	93.909 ± 0.003°
γ	90°
Cell volume	4430.9 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.091
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.0846
Weighted residual factors for all reflections included in the refinement	0.0985
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
278642 (current)	2022-10-20	cif/ Adding structures of 7245688 via cif-deposit CGI script.	7245688.cif