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	hartrees
Energy at 0K	-130.963633
Energy at 298.15K	-130.967375
HF Energy	-130.842088
Nuclear repulsion energy	62.496011

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3564	3108	0.09
2	A'	3428	2989	11.80
3	A'	3374	2941	0.36
4	A'	1717	1497	4.23
5	A'	1598	1393	0.62
6	A'	1512	1318	9.43
7	A'	1289	1124	6.34
8	A'	1175	1025	10.34
9	A'	991	864	5.23
10	A'	443	386	9.85
11	A"	3543	3090	0.25
12	A"	1709	1490	3.35
13	A"	1183	1032	0.03
14	A"	789	688	6.87
15	A"	168	147	1.10

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.502	0.000
C2	-0.876	-0.769	0.000
N3	1.298	0.481	0.000
H4	-0.534	1.474	0.000
H5	-0.245	-1.673	0.000
H6	-1.524	-0.784	0.895
H7	-1.524	-0.784	-0.895

	C1	C2	N3	H4	H5	H6	H7
C1		1.5440	1.2982	1.1089	2.1889	2.1859	2.1859
C2	1.5440		2.5083	2.2691	1.1030	1.1048	1.1048
N3	1.2982	2.5083		2.0836	2.6498	3.2198	3.2198
H4	1.1089	2.2691	2.0836		3.1604	2.6230	2.6230
H5	2.1889	1.1030	2.6498	3.1604		1.7969	1.7969
H6	2.1859	1.1048	3.2198	2.6230	1.7969		1.7893
H7	2.1859	1.1048	3.2198	2.6230	1.7969	1.7893

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.468	C1	C2	H6	110.123
C1	C2	H7	110.123	C2	C1	N3	123.666
C2	C1	H4	116.637	N3	C1	H4	119.697
H5	C2	H6	108.961	H5	C2	H7	108.961
H6	C2	H7	108.156

All results from a given calculation for CH₃CHN (methylmethaniminyl radical)

using model chemistry: MP2/STO-3G

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 CH3CHN (methylmethaniminyl radical)

using model chemistry: MP2/STO-3G

States and conformations

All results from a given calculation for CH₃CHN (methylmethaniminyl radical)