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	hartrees
Energy at 0K	-188.836670
Energy at 298.15K	-188.844082
HF Energy	-188.088322
Nuclear repulsion energy	119.966878

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3180	3013	0.00
2	A_g	3081	2919	0.00
3	A_g	1689	1600	0.00
4	A_g	1505	1426	0.00
5	A_g	1447	1371	0.00
6	A_g	1242	1176	0.00
7	A_g	950	900	0.00
8	A_g	606	574	0.00
9	A_u	3167	3000	22.80
10	A_u	1509	1429	11.03
11	A_u	1157	1096	1.17
12	A_u	293	278	6.50
13	A_u	150	142	1.50
14	B_g	3167	3000	0.00
15	B_g	1508	1429	0.00
16	B_g	1060	1004	0.00
17	B_g	208	197	0.00
18	B_u	3180	3013	24.32
19	B_u	3080	2918	35.54
20	B_u	1512	1432	18.02
21	B_u	1445	1369	2.22
22	B_u	1158	1097	0.85
23	B_u	1056	1001	5.06
24	B_u	358	339	14.12

Atom	x (Å)	y (Å)	z (Å)
N1	0.376	0.494	0.000
N2	-0.376	-0.494	0.000
C3	-0.376	1.754	0.000
C4	0.376	-1.754	0.000
H5	-1.455	1.584	0.000
H6	1.455	-1.584	0.000
H7	-0.077	2.326	0.882
H8	-0.077	2.326	-0.882
H9	0.077	-2.326	0.882
H10	0.077	-2.326	-0.882

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2423	1.4670	2.2483	2.1306	2.3416	2.0824	2.0824	2.9699	2.9699
N2	1.2423		2.2483	1.4670	2.3416	2.1306	2.9699	2.9699	2.0824	2.0824
C3	1.4670	2.2483		3.5875	1.0921	3.8070	1.0926	1.0926	4.1983	4.1983
C4	2.2483	1.4670	3.5875		3.8070	1.0921	4.1983	4.1983	1.0926	1.0926
H5	2.1306	2.3416	1.0921	3.8070		4.3014	1.7962	1.7962	4.2906	4.2906
H6	2.3416	2.1306	3.8070	1.0921	4.3014		4.2906	4.2906	1.7962	1.7962
H7	2.0824	2.9699	1.0926	4.1983	1.7962	4.2906		1.7632	4.6541	4.9769
H8	2.0824	2.9699	1.0926	4.1983	1.7962	4.2906	1.7632		4.9769	4.6541
H9	2.9699	2.0824	4.1983	1.0926	4.2906	1.7962	4.6541	4.9769		1.7632
H10	2.9699	2.0824	4.1983	1.0926	4.2906	1.7962	4.9769	4.6541	1.7632

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	111.900	N1	C3	H5	111.891
N1	C3	H7	107.999	N1	C3	H8	107.999
N2	N1	C3	111.900	N2	C4	H6	111.891
N2	C4	H9	107.999	N2	C4	H10	107.999
H5	C3	H7	110.607	H5	C3	H8	110.607
H6	C4	H9	110.607	H6	C4	H10	110.607
H7	C3	H8	107.583	H9	C4	H10	107.583

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

using model chemistry: QCISD/6-31G(2df,p)

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: QCISD/6-31G(2df,p)

States and conformations

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