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	hartrees
Energy at 0K	-148.543658
Energy at 298.15K	-148.545727
HF Energy	-148.432158
Nuclear repulsion energy	58.659269

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3653	3653	64.98
2	A₁	2258	2258	90.62
3	A₁	1710	1710	71.23
4	A₁	1105	1105	9.42
5	B₁	458	458	172.96
6	B₁	405	405	319.60
7	B₂	3779	3779	71.85
8	B₂	1197	1197	6.62
9	B₂	378	378	0.69

Atom	y (Å)	z (Å)
C1	0.000	0.217
N2	0.000	1.405
N3	0.000	-1.124
H4	0.865	-1.637
H5	-0.865	-1.637

	C1	N2	N3	H4	H5
C1		1.1879	1.3409	2.0458	2.0458
N2	1.1879		2.5288	3.1625	3.1625
N3	1.3409	2.5288		1.0054	1.0054
H4	2.0458	3.1625	1.0054		1.7291
H5	2.0458	3.1625	1.0054	1.7291

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.696		C1	N3	H5	120.696
N2	C1	N3	180.000		H4	N3	H5	118.608

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: B2PLYP=FULL/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: B2PLYP=FULL/6-31G

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)