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	hartrees
Energy at 0K	-147.397382
Energy at 298.15K	-147.399157
HF Energy	-147.078730
Nuclear repulsion energy	58.445690

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3605	3418	70.75
2	A₁	2227	2112	53.32
3	A₁	1730	1640	67.83
4	A₁	1061	1006	14.24
5	B₁	473	448	4.66
6	B₁	125	118	460.59
7	B₂	3725	3532	75.00
8	B₂	1205	1142	6.29
9	B₂	447	423	0.30

Atom	y (Å)	z (Å)
C1	0.000	0.219
N2	0.000	1.410
N3	0.000	-1.129
H4	0.870	-1.640
H5	-0.870	-1.640

	C1	N2	N3	H4	H5
C1		1.1913	1.3471	2.0520	2.0520
N2	1.1913		2.5384	3.1713	3.1713
N3	1.3471	2.5384		1.0093	1.0093
H4	2.0520	3.1713	1.0093		1.7405
H5	2.0520	3.1713	1.0093	1.7405

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.431		C1	N3	H5	120.431
N2	C1	N3	180.000		H4	N3	H5	119.138

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: MP2=FULL/3-21G*

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: MP2=FULL/3-21G*

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)