CCCBDB listing of experimental data page 2

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Property	Value	units	Reference
Hfg(298.15K)	-512.00	kJ mol^-1	Gurvich
Hfg(0K)		kJ mol^-1	Gurvich
Entropy (298.15K)	287.64	J K^-1 mol^-1	Gurvich
Integrated Heat Capacity (0 to 298.15K)	16.22	kJ mol^-1	Gurvich
Heat Capacity (298.15K)	93.89	J K^-1 mol^-1

Description	Value	unc.	Connectivity				Reference	Comment
Description	Value	unc.	Atom 1	Atom 2	Atom 3	Atom 4	Reference	Comment
rBN	1.436	0.004	1	6			1976Hellwege(II/7)
rNH	1.050	0.020	1	7			1976Hellwege(II/7)
aNBN	117.7	2	1	5	3		1976Hellwege(II/7)
aBNB	121.1	2	4	2	6		1976Hellwege(II/7)
aHNB	119.5	2	6	1	7		1976Hellwege(II/7)
aHBN	121.2	2	2	4	10		1976Hellwege(II/7)

Bond Type	Count
B:N	6
H-N	3
H-B	3

Atom 1	Atom 2
N1	B5
N1	B6
N1	H7
N2	B4
N2	B6
N2	H8
N3	B4
N3	B5
N3	H9
B4	H10
B5	H11
B6	H12

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							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
1976Hellwege(II/7)	Hellwege, KH and AM Hellwege (ed.). Landolt-Bornstein: Group II: Atomic and Molecular Physics Volume 7: Structure Data of Free Polyatomic Molecules. Springer-Verlag. Berlin. 1976.
Gurvich	Gurvich, L.V.; Veyts, I. V.; Alcock, C. B., Thermodynamic Properties of Individual Substances, Fouth Edition, Hemisphere Pub. Co., New York, 1989
HCP_Polar	TM Miller, Handbook of Chemistry and Physics Online (http://hbcponline.com/faces/documents/10_04/10_04_0001.xhtml)
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for B3N3H6 (borazine)

Experimental data for B₃N₃H₆ (borazine)