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	hartrees
Energy at 0K	-517.329040
Energy at 298.15K
HF Energy	-517.329040
Nuclear repulsion energy	49.681605

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3372	3353	1.49
2	A₁	1929	1918	2438.47
3	A₁	1109	1102	39.72
4	A₁	225	224	46.48
5	E	3493	3474	12.20
5	E	3493	3474	12.20
6	E	1629	1621	18.64
6	E	1629	1621	18.64
7	E	887	882	47.03
7	E	887	882	47.03
8	E	255	253	13.18
8	E	255	253	13.18

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.860
Cl2	0.000	0.000	1.172
H3	0.000	0.953	-2.235
H4	0.825	-0.476	-2.235
H5	-0.825	-0.476	-2.235
H6	0.000	0.000	-0.205

	N1	Cl2	H3	H4	H5	H6
N1		3.0325	1.0242	1.0242	1.0242	1.6552
Cl2	3.0325		3.5386	3.5386	3.5386	1.3773
H3	1.0242	3.5386		1.6506	1.6506	2.2430
H4	1.0242	3.5386	1.6506		1.6506	2.2430
H5	1.0242	3.5386	1.6506	1.6506		2.2430
H6	1.6552	1.3773	2.2430	2.2430	2.2430

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	107.372
H3	N1	H5	107.372	H3	N1	H6	111.496
H4	N1	H5	107.372	H4	N1	H6	111.496
H5	N1	H6	111.496

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

using model chemistry: BLYP/6-31G(2df,p)

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	-0.626
2	Cl	-0.452
3	H	0.255
4	H	0.255
5	H	0.255
6	H	0.313

	x	y	z	Total
	0.000	0.000	-5.444	5.444
CHELPG
AIM
ESP

<r²>	76.684
(<r²>)^1/2	8.757

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

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

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