Crystallography Open Database

Information card for entry 7134167

Preview

Coordinates	7134167.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	reducted profuct
Formula	C23 H20 N2
Calculated formula	C23 H20 N2
Title of publication	Synthesis of indole-fused benzodiazepine derivatives by photocatalyzed cascade reaction.
Authors of publication	Oishi, Tatsushi; Uchikura, Tatsuhiro; Akiyama, Takahiko
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	12
Pages of publication	2576 - 2579
a	11.0423 ± 0.0008 Å
b	15.3916 ± 0.001 Å
c	11.2723 ± 0.0008 Å
α	90°
β	117.011 ± 0.009°
γ	90°
Cell volume	1706.8 ± 0.2 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.0527
Weighted residual factors for significantly intense reflections	0.1359
Weighted residual factors for all reflections included in the refinement	0.1479
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation probe	x-ray
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
298079 (current)	2025-03-04	cif/ Updating files of 7134167 Original log message: Adding full bibliography for 7134167.cif.	7134167.cif
297305	2025-01-14	cif/ Adding structures of 7134167 via cif-deposit CGI script.	7134167.cif