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	hartrees
Energy at 0K	-132.978105
Energy at 298.15K	-132.982057
HF Energy	-132.506561
Nuclear repulsion energy	64.600799

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3220	3055	5.20
2	A'	3101	2941	5.76
3	A'	3056	2899	17.87
4	A'	2112	2003	74.80
5	A'	1500	1423	13.38
6	A'	1407	1334	5.40
7	A'	1277	1211	4.20
8	A'	1083	1028	11.38
9	A'	941	893	1.40
10	A'	443	420	21.99
11	A"	3191	3027	6.98
12	A"	1503	1425	10.98
13	A"	1143	1084	1.59
14	A"	799	758	7.38
15	A"	208	197	1.97

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.482	0.000
C2	-0.819	-0.786	0.000
N3	1.221	0.522	0.000
H4	-0.557	1.432	0.000
H5	-0.165	-1.657	0.000
H6	-1.458	-0.805	0.885
H7	-1.458	-0.805	-0.885

	C1	C2	N3	H4	H5	H6	H7
C1		1.5098	1.2220	1.1008	2.1460	2.1369	2.1369
C2	1.5098		2.4236	2.2336	1.0892	1.0923	1.0923
N3	1.2220	2.4236		1.9972	2.5831	3.1183	3.1183
H4	1.1008	2.2336	1.9972		3.1141	2.5688	2.5688
H5	2.1460	1.0892	2.5831	3.1141		1.7842	1.7842
H6	2.1369	1.0923	3.1183	2.5688	1.7842		1.7706
H7	2.1369	1.0923	3.1183	2.5688	1.7842	1.7706

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.274	C1	C2	H6	109.367
C1	C2	H7	109.367	C2	C1	N3	124.711
C2	C1	H4	116.783	N3	C1	H4	118.506
H5	C2	H6	109.751	H5	C2	H7	109.751
H6	C2	H7	108.298

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

using model chemistry: MP2=FULL/6-311G**

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=FULL/6-311G**

States and conformations

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