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	hartrees
Energy at 0K	-148.436416
Energy at 298.15K
HF Energy	-147.961606
Nuclear repulsion energy	59.637409

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3716	3475	77.02
2	A₁	2446	2288	134.45
3	A₁	1657	1550	55.67
4	A₁	1144	1070	16.37
5	B₁	517	483	0.14
6	B₁	528i	494i	312.47
7	B₂	3838	3590	99.21
8	B₂	1156	1081	2.38
9	B₂	415	388	0.03

Atom	y (Å)	z (Å)
C1	0.000	0.223
N2	0.000	1.377
N3	0.000	-1.108
H4	0.864	-1.610
H5	-0.864	-1.610

	C1	N2	N3	H4	H5
C1		1.1531	1.3314	2.0271	2.0271
N2	1.1531		2.4846	3.1093	3.1093
N3	1.3314	2.4846		0.9994	0.9994
H4	2.0271	3.1093	0.9994		1.7281
H5	2.0271	3.1093	0.9994	1.7281

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.169		C1	N3	H5	120.169
N2	C1	N3	180.000		H4	N3	H5	119.661

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: MP3/TZVP

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

	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 NH2CN (cyanamide)

using model chemistry: MP3/TZVP

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)