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	hartrees
Energy at 0K	-515.450480
Energy at 298.15K	-515.453114
HF Energy	-515.080928
Nuclear repulsion energy	50.890957

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3453	3453	3.15
2	A'	1597	1597	19.09
3	A'	1106	1106	50.51
4	A'	686	686	1.79
5	A"	3550	3550	9.97
6	A"	1197	1197	0.14

Atom	x (Å)	y (Å)	z (Å)
N1	-0.045	1.148	0.000
Cl2	-0.045	-0.635	0.000
H3	0.537	1.379	0.811
H4	0.537	1.379	-0.811

	N1	Cl2	H3	H4
N1		1.7823	1.0248	1.0248
Cl2	1.7823		2.2478	2.2478
H3	1.0248	2.2478		1.6220
H4	1.0248	2.2478	1.6220

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	N1	H3	103.061		Cl2	N1	H4	103.061
H3	N1	H4	104.626

All results from a given calculation for NH₂Cl (chloramine)

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

States and conformations

All results from a given calculation for NH₂Cl (chloramine)