Crystallography Open Database

Information card for entry 7239330

Preview

Coordinates	7239330.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	methyl 6-propyl-9H-carbazole-3-carboxylate
Formula	C17 H17 N O2
Calculated formula	C17 H17 N O2
Title of publication	C‒N bond formation via Cu-catalyzed cross-coupling with boronic acids leading to methyl carbazole-3-carboxylate: synthesis of carbazole alkaloids
Authors of publication	Rasheed, Sk.; Rao, D. Nageswar; Reddy, K. Ranjith; Aravinda, S.; Vishwakarma, Ram A.; Das, Parthasarathi
Journal of publication	RSC Advances
Year of publication	2014
Journal volume	4
Journal issue	10
Pages of publication	4960
a	12.8565 ± 0.0007 Å
b	13.821 ± 0.0007 Å
c	8.0271 ± 0.0004 Å
α	90°
β	98.229 ± 0.005°
γ	90°
Cell volume	1411.65 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.0856
Residual factor for significantly intense reflections	0.052
Weighted residual factors for significantly intense reflections	0.1298
Weighted residual factors for all reflections included in the refinement	0.1561
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
244656 (current)	2019-11-28	cif/ Adding structures of 7239330 via cif-deposit CGI script.	7239330.cif