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	hartrees
Energy at 0K	-517.312412
Energy at 298.15K
HF Energy	-517.312412
Nuclear repulsion energy	49.577409

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3352	3325	2.18
2	A₁	1816	1801	2307.05
3	A₁	1153	1143	32.44
4	A₁	247	245	44.10
5	E	3482	3454	9.01
5	E	3482	3454	9.01
6	E	1668	1654	22.74
6	E	1668	1654	22.74
7	E	916	909	76.13
7	E	916	909	76.13
8	E	278	275	16.56
8	E	278	275	16.56

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.861
Cl2	0.000	0.000	1.174
H3	0.000	0.956	-2.236
H4	0.828	-0.478	-2.236
H5	-0.828	-0.478	-2.236
H6	0.000	0.000	-0.219

	N1	Cl2	H3	H4	H5	H6
N1		3.0342	1.0273	1.0273	1.0273	1.6413
Cl2	3.0342		3.5414	3.5414	3.5414	1.3929
H3	1.0273	3.5414		1.6560	1.6560	2.2322
H4	1.0273	3.5414	1.6560		1.6560	2.2322
H5	1.0273	3.5414	1.6560	1.6560		2.2322
H6	1.6413	1.3929	2.2322	2.2322	2.2322

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	107.418
H3	N1	H5	107.418	H3	N1	H6	111.454
H4	N1	H5	107.418	H4	N1	H6	111.454
H5	N1	H6	111.454

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

using model chemistry: BLYP/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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Number	Element	Mulliken
1	N	-0.834
2	Cl	-0.373
3	H	0.328
4	H	0.328
5	H	0.328
6	H	0.223

	x	y	z	Total
	0.000	0.000	-5.893	5.893
CHELPG
AIM
ESP

<r²>	76.792
(<r²>)^1/2	8.763

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

using model chemistry: BLYP/6-31G*

States and conformations

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