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	hartrees
Energy at 0K	-261.195006
Energy at 298.15K
HF Energy	-260.545978
Nuclear repulsion energy	165.115065

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3420	3159	0.71
2	A₁	1581	1460	12.10
3	A₁	1438	1329	5.17
4	A₁	1119	1034	10.34
5	A₁	1109	1025	24.90
6	A₁	976	902	24.52
7	A₂	943	871	0.00
8	A₂	683	631	0.00
9	B₁	915	845	37.76
10	B₁	678	626	0.88
11	B₂	3407	3147	0.01
12	B₂	1720	1589	0.31
13	B₂	1290	1191	4.42
14	B₂	1075	993	1.65
15	B₂	1017	940	22.30

Atom	y (Å)	z (Å)
O1	0.000	1.113
N2	1.116	0.354
N3	-1.116	0.354
C4	0.710	-0.873
C5	-0.710	-0.873
H6	1.405	-1.692
H7	-1.405	-1.692

	O1	N2	N3	C4	C5	H6	H7
O1		1.3492	1.3492	2.1087	2.1087	3.1365	3.1365
N2	1.3492		2.2319	1.2929	2.1999	2.0665	3.2465
N3	1.3492	2.2319		2.1999	1.2929	3.2465	2.0665
C4	2.1087	1.2929	2.1999		1.4195	1.0739	2.2673
C5	2.1087	2.1999	1.2929	1.4195		2.2673	1.0739
H6	3.1365	2.0665	3.2465	1.0739	2.2673		2.8091
H7	3.1365	3.2465	2.0665	2.2673	1.0739	2.8091

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N2	C4	105.885	O1	N3	C5	105.885
N2	O1	N3	111.610	N2	C4	C5	108.310
N2	C4	H6	121.375	N3	C5	C4	108.310
N3	C5	H7	121.375	C4	C5	H7	130.315
C5	C4	H6	130.315

All results from a given calculation for C₂H₂N₂O (Furazan)

using model chemistry: CID/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for C2H2N2O (Furazan)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for C₂H₂N₂O (Furazan)