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	hartrees
Energy at 0K	-148.360984
Energy at 298.15K
HF Energy	-147.903799
Nuclear repulsion energy	59.014998

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3664	3460	77.86
2	A₁	2370	2238	97.22
3	A₁	1665	1572	60.48
4	A₁	1134	1071	13.32
5	B₁	498	471	0.84
6	B₁	514i	485i	372.85
7	B₂	3783	3572	90.18
8	B₂	1162	1097	4.60
9	B₂	392	370	0.01

Atom	y (Å)	z (Å)
C1	0.000	0.221
N2	0.000	1.393
N3	0.000	-1.118
H4	0.869	-1.628
H5	-0.869	-1.628

	C1	N2	N3	H4	H5
C1		1.1716	1.3392	2.0434	2.0434
N2	1.1716		2.5108	3.1437	3.1437
N3	1.3392	2.5108		1.0075	1.0075
H4	2.0434	3.1437	1.0075		1.7372
H5	2.0434	3.1437	1.0075	1.7372

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.441		C1	N3	H5	120.441
N2	C1	N3	180.000		H4	N3	H5	119.118

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: CCSD/6-31G*

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: CCSD/6-31G*

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)