Crystallography Open Database

Information card for entry 7703125

Preview

Coordinates	7703125.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H23 B Cl2 F2 N4 O
Calculated formula	C36 H23 B Cl2 F2 N4 O
Title of publication	Photophysical properties of some novel tetraphenylimidazole derived BODIPY based fluorescent molecular rotors.
Authors of publication	Dwivedi, Bhupendra Kumar; Singh, Vishwa Deepak; Kumar, Yogesh; Pandey, Daya Shankar
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	2
Pages of publication	438 - 452
a	9.5668 ± 0.0007 Å
b	13.2433 ± 0.0009 Å
c	13.9708 ± 0.0009 Å
α	104.534 ± 0.002°
β	103.397 ± 0.002°
γ	104.401 ± 0.002°
Cell volume	1575.8 ± 0.19 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0801
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.126
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
246457 (current)	2020-01-03	cif/ Adding structures of 7703122, 7703123, 7703124, 7703125 via cif-deposit CGI script.	7703125.cif