Crystallography Open Database

Information card for entry 7064221

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Coordinates	7064221.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H18 N2 O3
Calculated formula	C16 H18 N2 O3
Title of publication	A hydrazone-based fluorescent chemosensor for Al3+: turn-on response induced by ESIPT suppression
Authors of publication	Bhat, Muzzaffar A.; Jan, Tabasum; Ashraf, Refat; Ali, Muneeba; Mushtaq, Asmat; Bhat, Sajad A.; Butcher, Ray J.; Din Reshi, Noor U.
Journal of publication	New Journal of Chemistry
Year of publication	2026
Journal volume	50
Journal issue	6
Pages of publication	2937 - 2947
a	12.5814 ± 0.0004 Å
b	11.6665 ± 0.0003 Å
c	10.1069 ± 0.0003 Å
α	90°
β	102.112 ± 0.002°
γ	90°
Cell volume	1450.48 ± 0.07 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0603
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.1096
Weighted residual factors for all reflections included in the refinement	0.1211
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

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