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	hartrees
Energy at 0K	-664.179254
Energy at 298.15K	-664.181290
HF Energy	-663.479155
Nuclear repulsion energy	155.943694

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1402	1306	354.96
2	A₁	832	775	225.32
3	A₁	422	394	44.01
4	B₁	687	640	6.24
5	B₂	1843	1717	497.17
6	B₂	443	413	0.12

Atom	y (Å)	z (Å)
Cl1	0.000	1.267
N2	0.000	-0.601
O3	1.089	-1.083
O4	-1.089	-1.083

	Cl1	N2	O3	O4
Cl1		1.8678	2.5897	2.5897
N2	1.8678		1.1905	1.1905
O3	2.5897	1.1905		2.1772
O4	2.5897	1.1905	2.1772

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl1	N2	O3	113.882		Cl1	N2	O4	113.882
O3	N2	O4	132.237

All results from a given calculation for ClNO₂ (Nitryl chloride)

using model chemistry: MP3=FULL/6-31+G**

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 ClNO2 (Nitryl chloride)

using model chemistry: MP3=FULL/6-31+G**

States and conformations

All results from a given calculation for ClNO₂ (Nitryl chloride)