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	hartrees
Energy at 0K	-186.382239
Energy at 298.15K
HF Energy	-185.773696
Nuclear repulsion energy	91.719045

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3265	3265	3.66
2	A'	3135	3135	10.46
3	A'	2373	2373	27.74
4	A'	1726	1726	17.02
5	A'	1513	1513	13.26
6	A'	1242	1242	9.28
7	A'	948	948	4.18
8	A'	637	637	2.86
9	A'	255	255	6.22
10	A"	1102	1102	20.03
11	A"	782	782	0.60
12	A"	368	368	8.73

Atom	x (Å)	y (Å)
C1	0.094	-1.547
N2	-0.645	-0.495
C3	0.000	0.712
N4	0.452	1.787
H5	-0.409	-2.517
H6	1.191	-1.517

	C1	N2	C3	N4	H5	H6
C1		1.2853	2.2605	3.3531	1.0931	1.0982
N2	1.2853		1.3678	2.5317	2.0364	2.1015
C3	2.2605	1.3678		1.1665	3.2550	2.5275
N4	3.3531	2.5317	1.1665		4.3898	3.3859
H5	1.0931	2.0364	3.2550	4.3898		1.8873
H6	1.0982	2.1015	2.5275	3.3859	1.8873

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	116.834	N2	C1	H5	117.564
N2	C1	H6	123.511	N2	C3	N4	174.711
H5	C1	H6	118.925

All results from a given calculation for H₂CNCN (cyanamide, methylene)

using model chemistry: MP3=FULL/aug-cc-pVDZ

States and conformations

	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 H2CNCN (cyanamide, methylene)

using model chemistry: MP3=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for H₂CNCN (cyanamide, methylene)