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	hartrees
Energy at 0K	-132.908382
Energy at 298.15K	-132.912246
HF Energy	-132.482971
Nuclear repulsion energy	63.547050

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3195	3195
2	A'	3077	3077
3	A'	3069	3069
4	A'	1688	1688
5	A'	1466	1466
6	A'	1373	1373
7	A'	1240	1240
8	A'	1066	1066
9	A'	924	924
10	A'	425	425
11	A"	3167	3167
12	A"	1470	1470
13	A"	1055	1055
14	A"	732	732
15	A"	192	192

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.489	0.000
C2	-0.856	-0.761	0.000
N3	1.267	0.479	0.000
H4	-0.507	1.473	0.000
H5	-0.223	-1.658	0.000
H6	-1.502	-0.768	0.891
H7	-1.502	-0.768	-0.891

	C1	C2	N3	H4	H5	H6	H7
C1		1.5152	1.2674	1.1064	2.1592	2.1519	2.1519
C2	1.5152		2.4589	2.2608	1.0983	1.1008	1.1008
N3	1.2674	2.4589		2.0335	2.6057	3.1653	3.1653
H4	1.1064	2.2608	2.0335		3.1440	2.6084	2.6084
H5	2.1592	1.0983	2.6057	3.1440		1.7957	1.7957
H6	2.1519	1.1008	3.1653	2.6084	1.7957		1.7823
H7	2.1519	1.1008	3.1653	2.6084	1.7957	1.7823

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.398	C1	C2	H6	109.673
C1	C2	H7	109.673	C2	C1	N3	123.942
C2	C1	H4	118.334	N3	C1	H4	117.725
H5	C2	H6	109.483	H5	C2	H7	109.483
H6	C2	H7	108.093

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

using model chemistry: ROMP2/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 CH3CHN (methylmethaniminyl radical)

using model chemistry: ROMP2/aug-cc-pVDZ

States and conformations

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