Crystallography Open Database

Information card for entry 1571310

Preview

Coordinates	1571310.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	P2Mac
Formula	C26 H24 N6 O3
Calculated formula	C26 H24 N6 O3
Title of publication	Self-assembly of water-filled molecular saddles to generate diverse morphologies and high proton conductivity.
Authors of publication	Pradhan, Nyaya Prakash; Gupta, Sweety; Ghosh, Swapnendu Narayan; Paul, Amit; Talukder, Santanu; Srivastava, Aasheesh
Journal of publication	Nanoscale
Year of publication	2024
Journal volume	16
Journal issue	17
Pages of publication	8427 - 8433
a	15.1491 ± 0.0013 Å
b	8.24 ± 0.0006 Å
c	17.97 ± 0.0013 Å
α	90°
β	91.932 ± 0.004°
γ	90°
Cell volume	2241.9 ± 0.3 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1239
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.1107
Weighted residual factors for all reflections included in the refinement	0.1445
Goodness-of-fit parameter for all reflections included in the refinement	1.0134
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
291662 (current)	2024-05-05	cif/ Updating files of 1571310 Original log message: Adding full bibliography for 1571310.cif.	1571310.cif
290706	2024-03-29	cif/ Adding structures of 1571310 via cif-deposit CGI script.	1571310.cif