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	hartrees
Energy at 0K	-132.885215
Energy at 298.15K	-132.889163
HF Energy	-132.484586
Nuclear repulsion energy	64.554476

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3262	3068	4.75
2	A'	3137	2950	6.15
3	A'	3107	2922	15.57
4	A'	2112	1986	98.11
5	A'	1526	1435	14.03
6	A'	1437	1351	4.83
7	A'	1299	1222	3.67
8	A'	1101	1035	11.39
9	A'	951	895	1.22
10	A'	449	422	23.00
11	A"	3232	3040	5.56
12	A"	1524	1434	11.33
13	A"	1161	1092	3.08
14	A"	807	759	7.87
15	A"	198	187	2.80

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.481	0.000
C2	-0.825	-0.780	0.000
N3	1.228	0.515	0.000
H4	-0.545	1.433	0.000
H5	-0.179	-1.654	0.000
H6	-1.463	-0.795	0.882
H7	-1.463	-0.795	-0.882

	C1	C2	N3	H4	H5	H6	H7
C1		1.5071	1.2288	1.0966	2.1424	2.1324	2.1324
C2	1.5071		2.4276	2.2309	1.0862	1.0890	1.0890
N3	1.2288	2.4276		1.9966	2.5854	3.1205	3.1205
H4	1.0966	2.2309	1.9966		3.1083	2.5663	2.5663
H5	2.1424	1.0862	2.5854	3.1083		1.7788	1.7788
H6	2.1324	1.0890	3.1205	2.5663	1.7788		1.7648
H7	2.1324	1.0890	3.1205	2.5663	1.7788	1.7648

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.348	C1	C2	H6	109.388
C1	C2	H7	109.388	C2	C1	N3	124.758
C2	C1	H4	117.044	N3	C1	H4	118.199
H5	C2	H6	109.718	H5	C2	H7	109.718
H6	C2	H7	108.247

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

using model chemistry: MP2/6-31+G**

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: MP2/6-31+G**

States and conformations

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