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	hartrees
Energy at 0K	-516.703316
Energy at 298.15K
HF Energy	-516.307138
Nuclear repulsion energy	48.629072

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3463	3463	0.17
2	A₁	2470	2470	1519.21
3	A₁	1147	1147	115.72
4	A₁	172	172	21.86
5	E	3598	3598	9.38
5	E	3598	3598	9.38
6	E	1660	1660	17.81
6	E	1660	1660	17.81
7	E	733	733	34.64
7	E	733	733	34.64
8	E	216	216	15.51
8	E	216	216	15.51

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.941
Cl2	0.000	0.000	1.216
H3	0.000	0.946	-2.326
H4	0.819	-0.473	-2.326
H5	-0.819	-0.473	-2.326
H6	0.000	0.000	-0.110

	N1	Cl2	H3	H4	H5	H6
N1		3.1566	1.0211	1.0211	1.0211	1.8305
Cl2	3.1566		3.6660	3.6660	3.6660	1.3262
H3	1.0211	3.6660		1.6379	1.6379	2.4091
H4	1.0211	3.6660	1.6379		1.6379	2.4091
H5	1.0211	3.6660	1.6379	1.6379		2.4091
H6	1.8305	1.3262	2.4091	2.4091	2.4091

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	106.644
H3	N1	H5	106.644	H3	N1	H6	112.169
H4	N1	H5	106.644	H4	N1	H6	112.169
H5	N1	H6	112.169

All results from a given calculation for NH₄Cl (Ammonium chloride)

using model chemistry: CCSD/daug-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 NH4Cl (Ammonium chloride)

using model chemistry: CCSD/daug-cc-pVDZ

States and conformations

All results from a given calculation for NH₄Cl (Ammonium chloride)