Crystallography Open Database

Information card for entry 1564308

Preview

Coordinates	1564308.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H10 O3
Calculated formula	C6 H10 O3
Title of publication	Alkyl Substituted Beta-Keto Acids: Molecular Structure and Decarboxylation Kinetics in Aqueous Solution and on the Surface of Metal Oxides
Authors of publication	Ignatchenko, Alexey; Springer, Morgan; Walker, Jordan; Brennessel, William
Journal of publication	Journal of Physical Chemistry
Year of publication	2021
Journal volume	125
Pages of publication	3368 - 3384
a	4.8902 Å
b	28.1219 Å
c	5.1787 Å
α	90°
β	98.915°
γ	90°
Cell volume	703.58 Å³
Number of distinct elements	3
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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