Crystallography Open Database

Information card for entry 7701355

Preview

Coordinates	7701355.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H76 B2 F4 N10 O2 P2 Pt
Calculated formula	C58 H76 B2 F4 N10 O2 P2 Pt
Title of publication	Altering the optoelectronic properties of boron difluoride formazanate dyes <i>via</i> conjugation with platinum(II)-acetylides.
Authors of publication	Dhindsa, Jasveer S.; Melenbacher, Adyn; Barbon, Stephanie M.; Stillman, Martin J.; Gilroy, Joe B.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	45
Pages of publication	16133 - 16142
a	10.602 ± 0.003 Å
b	11.265 ± 0.003 Å
c	25.144 ± 0.005 Å
α	81.695 ± 0.006°
β	84.894 ± 0.006°
γ	88.797 ± 0.011°
Cell volume	2959.6 ± 1.3 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0411
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0568
Weighted residual factors for all reflections included in the refinement	0.0594
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
260791 (current)	2021-01-07	cif/ Updating files of 7701355 Original log message: Adding full bibliography for 7701355.cif.	7701355.cif
219267	2019-10-11	cif/ Adding structures of 7701355 via cif-deposit CGI script.	7701355.cif