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	hartrees
Energy at 0K	-149.588618
Energy at 298.15K
HF Energy	-149.087741
Nuclear repulsion energy	71.919469

Atom	x (Å)	y (Å)	z (Å)
C1	-0.124	0.400	-0.003
N2	1.146	-0.146	-0.085
N3	-1.171	-0.337	0.019
H4	-0.122	1.492	-0.018
H5	1.877	0.377	0.367
H6	1.164	-1.133	0.128
H7	-2.000	0.251	0.002

	C1	N2	N3	H4	H5	H6	H7
C1		1.3845	1.2803	1.0923	2.0356	2.0064	1.8818
N2	1.3845		2.3265	2.0724	1.0069	1.0093	3.1717
N3	1.2803	2.3265		2.1089	3.1499	2.4691	1.0171
H4	1.0923	2.0724	2.1089		2.3212	2.9265	2.2509
H5	2.0356	1.0069	3.1499	2.3212		1.6869	3.8965
H6	2.0064	1.0093	2.4691	2.9265	1.6869		3.4560
H7	1.8818	3.1717	1.0171	2.2509	3.8965	3.4560

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	115.788	C1	N2	H6	112.957
C1	N3	H7	109.450	N2	C1	N3	121.580
N2	C1	H4	113.064	N3	C1	H4	125.273
H5	N2	H6	113.582

Number	Element	Mulliken
1	C	0.353
2	N	-0.704
3	N	-0.624
4	H	0.123
5	H	0.290
6	H	0.308
7	H	0.254

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: QCISD/6-31G**

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	44.679
(<r²>)^1/2	6.684

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: QCISD/6-31G**

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)