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	hartrees
Energy at 0K	-133.133336
Energy at 298.15K	-133.137119
HF Energy	-132.524185
Nuclear repulsion energy	64.219812

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3143	3029
2	A'	3056	2945
3	A'	3013	2904
4	A'	1741	1678
5	A'	1491	1437
6	A'	1408	1357
7	A'	1251	1205
8	A'	1063	1024
9	A'	914	881
10	A'	424	409
11	A"	3117	3004
12	A"	1492	1437
13	A"	1065	1026
14	A"	744	717
15	A"	137	132

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.486	0.000
C2	-0.840	-0.765	0.000
N3	1.248	0.491	0.000
H4	-0.527	1.443	0.000
H5	-0.207	-1.649	0.000
H6	-1.480	-0.778	0.882
H7	-1.480	-0.778	-0.882

	C1	C2	N3	H4	H5	H6	H7
C1		1.5068	1.2476	1.0930	2.1447	2.1366	2.1366
C2	1.5068		2.4367	2.2308	1.0871	1.0895	1.0895
N3	1.2476	2.4367		2.0135	2.5878	3.1351	3.1351
H4	1.0930	2.2308	2.0135		3.1089	2.5733	2.5733
H5	2.1447	1.0871	2.5878	3.1089		1.7766	1.7766
H6	2.1366	1.0895	3.1351	2.5733	1.7766		1.7634
H7	2.1366	1.0895	3.1351	2.5733	1.7766	1.7634

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.496	C1	C2	H6	109.709
C1	C2	H7	109.709	C2	C1	N3	124.144
C2	C1	H4	117.313	N3	C1	H4	118.543
H5	C2	H6	109.418	H5	C2	H7	109.418
H6	C2	H7	108.049

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

using model chemistry: CCSD(T)=FULL/aug-cc-pVTZ

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: CCSD(T)=FULL/aug-cc-pVTZ

States and conformations

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