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	hartrees
Energy at 0K	-148.129418
Energy at 298.15K	-148.131423
HF Energy	-147.840304
Nuclear repulsion energy	58.813803

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3712	3481	68.54
2	A₁	2359	2212	106.17
3	A₁	1754	1645	73.70
4	A₁	1126	1056	10.00
5	B₁	421	395	92.68
6	B₁	371	348	443.01
7	B₂	3837	3598	75.11
8	B₂	1235	1158	6.52
9	B₂	372	349	0.20

Atom	y (Å)	z (Å)
C1	0.000	0.222
N2	0.000	1.400
N3	0.000	-1.123
H4	0.863	-1.634
H5	-0.863	-1.634

	C1	N2	N3	H4	H5
C1		1.1773	1.3456	2.0477	2.0477
N2	1.1773		2.5230	3.1545	3.1545
N3	1.3456	2.5230		1.0031	1.0031
H4	2.0477	3.1545	1.0031		1.7262
H5	2.0477	3.1545	1.0031	1.7262

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.639		C1	N3	H5	120.639
N2	C1	N3	180.000		H4	N3	H5	118.723

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: CISD/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: CISD/6-31G

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)