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	hartrees
Energy at 0K	-515.427621
Energy at 298.15K	-515.430260
HF Energy	-515.081095
Nuclear repulsion energy	51.063478

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3451	3344	3.93	111.10	0.06	0.11
2	A'	1584	1535	19.60	3.47	0.50	0.67
3	A'	1092	1058	54.05	1.33	0.07	0.13
4	A'	704	683	1.48	19.31	0.18	0.30
5	A"	3559	3449	15.29	39.61	0.75	0.86
6	A"	1192	1155	0.11	1.24	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	-0.045	1.142	0.000
Cl2	-0.045	-0.632	0.000
H3	0.538	1.375	0.811
H4	0.538	1.375	-0.811

	N1	Cl2	H3	H4
N1		1.7746	1.0253	1.0253
Cl2	1.7746		2.2418	2.2418
H3	1.0253	2.2418		1.6222
H4	1.0253	2.2418	1.6222

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	N1	H3	103.114		Cl2	N1	H4	103.114
H3	N1	H4	104.575

All results from a given calculation for NH₂Cl (chloramine)

using model chemistry: MP2=FULL/aug-cc-pVDZ

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 NH2Cl (chloramine)

using model chemistry: MP2=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for NH₂Cl (chloramine)