CCCBDB listing of experimental data page 2

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INChI	INChIKey	SMILES	IUPAC name
InChI=1S/Al.3H	AZDRQVAHHNSJOQ-UHFFFAOYSA-N	[AlH3]	Aluminum trihydride
InChI=1/Al.3H/rAlH3/h1H3	AZDRQVAHHNSJOQ-FSBNLZEDNA-N	[AlH3]	Aluminum trihydride

Property	Value	Uncertainty	units	Reference	Comment
Hfg(298.15K)	128.89	20.00	kJ mol^-1	Gurvich	estimate from theory! No experimental data!
Hfg(0K)	135.73	20.00	kJ mol^-1	Gurvich	estimate from theory! No experimental data!
Entropy (298.15K)	206.57		J K^-1 mol^-1	Gurvich
Integrated Heat Capacity (0 to 298.15K)	10.41		kJ mol^-1	Gurvich
Heat Capacity (298.15K)	40.06		J K^-1 mol^-1	Gurvich

Mode Number	Symmetry	Frequency			Intensity			Comment	Description
Mode Number	Symmetry	Fundamental(cm^-1)	Harmonic(cm^-1)	Reference	(km mol^-1)	unc.	Reference	Comment	Description
1	A₁'	1900		1993Kur/Ebe:1302
2	A₂"	698		1993Kur/Ebe:1302
3	E'	1883		1993Kur/Ebe:1302
4	E'	783		1993Kur/Ebe:1302

Atom 1	Atom 2
Al1	H2
Al1	H3
Al1	H4

State	Config	State description	Conf description	Exp. min.	Dipole (Debye)				Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	x	y	z	total	Reference	comment	Point Group	dipole	quadrupole
1	1	¹A₁^'	D_3h	True				0.000	NSRDS-NBS10		D_3h	0	1

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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squib	reference	DOI
1993Kur/Ebe:1302	FA Kurth, RA Eberlein, H Schnockel, AJ Downs, CR Pulham "Molecular Aluminum Trihydride, AlH3: Generation in a Solid Noble Gas Matrix and Characterisation by its Infrared Spectrum and Ab initio calculations" J. Chem. Soc. Chem. Commun. 1302, 1993	10.1039/c39930001302
Gurvich	Gurvich, L.V.; Veyts, I. V.; Alcock, C. B., Thermodynamic Properties of Individual Substances, Fouth Edition, Hemisphere Pub. Co., New York, 1989
NSRDS-NBS10	R. D. Nelson Jr., D. R. Lide, A. A. Maryott "Selected Values of electric dipole moments for molecules in the gas phase" NSRDS-NBS10, 1967	10.6028/NBS.NSRDS.10

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Experimental data for AlH3- (aluminum trihydride anion)

Experimental data for AlH₃^- (aluminum trihydride anion)