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	hartrees
Energy at 0K	-517.343840
Energy at 298.15K
HF Energy	-517.343840
Nuclear repulsion energy	49.910055

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3532	3532	5.05
2	A₁	2070	2070	2312.26
3	A₁	1145	1145	124.23
4	A₁	236	236	41.77
5	E	3677	3677	18.71
5	E	3677	3677	18.75
6	E	1681	1681	27.66
6	E	1681	1681	27.70
7	E	894	894	81.75
7	E	894	894	81.73
8	E	267	267	17.50
8	E	267	267	17.51

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.861
Cl2	0.000	0.000	1.170
H3	0.000	0.948	-2.224
H4	0.821	-0.474	-2.224
H5	-0.821	-0.474	-2.224
H6	0.000	0.000	-0.185

	N1	Cl2	H3	H4	H5	H6
N1		3.0312	1.0146	1.0146	1.0146	1.6765
Cl2	3.0312		3.5235	3.5235	3.5235	1.3547
H3	1.0146	3.5235		1.6414	1.6414	2.2484
H4	1.0146	3.5235	1.6414		1.6414	2.2484
H5	1.0146	3.5235	1.6414	1.6414		2.2484
H6	1.6765	1.3547	2.2484	2.2484	2.2484

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	107.974
H3	N1	H5	107.974	H3	N1	H6	110.930
H4	N1	H5	107.974	H4	N1	H6	110.930
H5	N1	H6	110.930

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

using model chemistry: wB97X-D/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	-0.782
2	Cl	-0.334
3	H	0.300
4	H	0.300
5	H	0.300
6	H	0.215

	x	y	z	Total
	0.000	0.000	-5.557	5.557
CHELPG
AIM
ESP

<r²>	76.356
(<r²>)^1/2	8.738

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

using model chemistry: wB97X-D/6-31G**

States and conformations

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