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	hartrees
Energy at 0K	-189.082325
Energy at 298.15K	-189.089753
HF Energy	-188.870823
Nuclear repulsion energy	119.775492

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3176	3176	0.00
2	A_g	3075	3075	0.00
3	A_g	1643	1643	0.00
4	A_g	1507	1507	0.00
5	A_g	1440	1440	0.00
6	A_g	1231	1231	0.00
7	A_g	941	941	0.00
8	A_g	599	599	0.00
9	A_u	3164	3164	30.36
10	A_u	1514	1514	11.41
11	A_u	1154	1154	0.98
12	A_u	291	291	6.64
13	A_u	162	162	2.52
14	B_g	3164	3164	0.00
15	B_g	1513	1513	0.00
16	B_g	1053	1053	0.00
17	B_g	224	224	0.00
18	B_u	3175	3175	33.90
19	B_u	3074	3074	44.27
20	B_u	1516	1516	19.82
21	B_u	1442	1442	1.30
22	B_u	1158	1158	0.44
23	B_u	1038	1038	6.79
24	B_u	354	354	14.09

Atom	x (Å)	y (Å)	z (Å)
N1	0.377	0.499	0.000
N2	-0.377	-0.499	0.000
C3	-0.377	1.756	0.000
C4	0.377	-1.756	0.000
H5	-1.455	1.590	0.000
H6	1.455	-1.590	0.000
H7	-0.076	2.328	0.880
H8	-0.076	2.328	-0.880
H9	0.076	-2.328	0.880
H10	0.076	-2.328	-0.880

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2504	1.4659	2.2555	2.1325	2.3513	2.0796	2.0796	2.9759	2.9759
N2	1.2504		2.2555	1.4659	2.3513	2.1325	2.9759	2.9759	2.0796	2.0796
C3	1.4659	2.2555		3.5928	1.0915	3.8154	1.0915	1.0915	4.2026	4.2026
C4	2.2555	1.4659	3.5928		3.8154	1.0915	4.2026	4.2026	1.0915	1.0915
H5	2.1325	2.3513	1.0915	3.8154		4.3114	1.7946	1.7946	4.2979	4.2979
H6	2.3513	2.1325	3.8154	1.0915	4.3114		4.2979	4.2979	1.7946	1.7946
H7	2.0796	2.9759	1.0915	4.2026	1.7946	4.2979		1.7603	4.6582	4.9797
H8	2.0796	2.9759	1.0915	4.2026	1.7946	4.2979	1.7603		4.9797	4.6582
H9	2.9759	2.0796	4.2026	1.0915	4.2979	1.7946	4.6582	4.9797		1.7603
H10	2.9759	2.0796	4.2026	1.0915	4.2979	1.7946	4.9797	4.6582	1.7603

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	112.026	N1	C3	H5	112.164
N1	C3	H7	107.917	N1	C3	H8	107.917
N2	N1	C3	112.026	N2	C4	H6	112.164
N2	C4	H9	107.917	N2	C4	H10	107.917
H5	C3	H7	110.591	H5	C3	H8	110.591
H6	C4	H9	110.591	H6	C4	H10	110.591
H7	C3	H8	107.488	H9	C4	H10	107.488

All results from a given calculation for CH₃NNCH₃ ((E)-1,2-Dimethyldiazene)

using model chemistry: B2PLYP=FULL/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 CH3NNCH3 ((E)-1,2-Dimethyldiazene)

using model chemistry: B2PLYP=FULL/6-31G**

States and conformations

All results from a given calculation for CH₃NNCH₃ ((E)-1,2-Dimethyldiazene)