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	hartrees
Energy at 0K	-148.442522
Energy at 298.15K
HF Energy	-147.929477
Nuclear repulsion energy	58.625604

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3626	3518
2	A₁	2264	2196
3	A₁	1622	1574
4	A₁	1093	1060
5	B₁	487	473
6	B₁	503i	488i
7	B₂	3760	3648
8	B₂	1126	1092
9	B₂	375	364

Atom	y (Å)	z (Å)
C1	0.000	0.221
N2	0.000	1.404
N3	0.000	-1.126
H4	0.872	-1.633
H5	-0.872	-1.633

	C1	N2	N3	H4	H5
C1		1.1829	1.3471	2.0491	2.0491
N2	1.1829		2.5301	3.1598	3.1598
N3	1.3471	2.5301		1.0089	1.0089
H4	2.0491	3.1598	1.0089		1.7447
H5	2.0491	3.1598	1.0089	1.7447

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N3	H4	120.164		C1	N3	H5	120.164
N2	C1	N3	180.000		H4	N3	H5	119.673

All results from a given calculation for NH₂CN (cyanamide)

using model chemistry: QCISD(T)=FULL/aug-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: QCISD(T)=FULL/aug-cc-pVDZ

States and conformations

Conformer 1 (Cs)

Conformer 2 (C2V)

All results from a given calculation for NH₂CN (cyanamide)