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	hartrees
Energy at 0K	-132.876821
Energy at 298.15K	-132.880778
HF Energy	-132.480721
Nuclear repulsion energy	64.603720

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3271	3064	5.03
2	A'	3146	2946	5.22
3	A'	3113	2915	18.22
4	A'	2123	1988	66.32
5	A'	1538	1441	10.32
6	A'	1444	1352	3.51
7	A'	1305	1223	3.27
8	A'	1105	1035	11.42
9	A'	955	894	1.25
10	A'	447	419	21.73
11	A"	3240	3034	7.25
12	A"	1541	1443	9.08
13	A"	1168	1094	1.06
14	A"	810	759	6.63
15	A"	204	191	2.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.482	0.000
C2	-0.823	-0.780	0.000
N3	1.227	0.514	0.000
H4	-0.550	1.431	0.000
H5	-0.175	-1.650	0.000
H6	-1.462	-0.799	0.881
H7	-1.462	-0.799	-0.881

	C1	C2	N3	H4	H5	H6	H7
C1		1.5068	1.2273	1.0962	2.1398	2.1344	2.1344
C2	1.5068		2.4243	2.2272	1.0855	1.0885	1.0885
N3	1.2273	2.4243		1.9991	2.5788	3.1193	3.1193
H4	1.0962	2.2272	1.9991		3.1037	2.5652	2.5652
H5	2.1398	1.0855	2.5788	3.1037		1.7769	1.7769
H6	2.1344	1.0885	3.1193	2.5652	1.7769		1.7628
H7	2.1344	1.0885	3.1193	2.5652	1.7769	1.7628

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.205	C1	C2	H6	109.597
C1	C2	H7	109.597	C2	C1	N3	124.610
C2	C1	H4	116.777	N3	C1	H4	118.613
H5	C2	H6	109.635	H5	C2	H7	109.635
H6	C2	H7	108.139

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

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

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: MP2/6-31G**

States and conformations

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