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	hartrees
Energy at 0K	-148.410659
Energy at 298.15K
HF Energy	-147.917235
Nuclear repulsion energy	58.548913

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3655	3527
2	A₁	2234	2156
3	A₁	1600	1544
4	A₁	1097	1059
5	B₁	484	467
6	B₁	579i	559i
7	B₂	3794	3661
8	B₂	1118	1079
9	B₂	379	365

Atom	y (Å)	z (Å)
C1	0.000	0.218
N2	0.000	1.407
N3	0.000	-1.126
H4	0.874	-1.634
H5	-0.874	-1.634

	C1	N2	N3	H4	H5
C1		1.1889	1.3439	2.0471	2.0471
N2	1.1889		2.5328	3.1633	3.1633
N3	1.3439	2.5328		1.0104	1.0104
H4	2.0471	3.1633	1.0104		1.7475
H5	2.0471	3.1633	1.0104	1.7475

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.143		C1	N3	H5	120.143
N2	C1	N3	180.000		H4	N3	H5	119.714

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: MP4=FULL/cc-pVDZ

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: MP4=FULL/cc-pVDZ

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)