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	hartrees
Energy at 0K	-189.208912
Energy at 298.15K	-189.216278
HF Energy	-189.208912
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3162	2999	0.00
2	A_g	3063	2905	0.00
3	A_g	1732	1643	0.00
4	A_g	1508	1430	0.00
5	A_g	1448	1373	0.00
6	A_g	1245	1181	0.00
7	A_g	959	910	0.00
8	A_g	609	578	0.00
9	A_u	3150	2988	30.05
10	A_u	1504	1427	15.36
11	A_u	1154	1095	0.38
12	A_u	292	277	7.61
13	A_u	129	123	2.53
14	B_g	3150	2988	0.00
15	B_g	1503	1426	0.00
16	B_g	1056	1001	0.00
17	B_g	209	198	0.00
18	B_u	3162	2999	35.60
19	B_u	3062	2904	46.48
20	B_u	1514	1436	25.32
21	B_u	1448	1374	1.71
22	B_u	1166	1106	0.21
23	B_u	1062	1007	8.22
24	B_u	361	343	15.09

Atom	x (Å)	y (Å)	z (Å)
N1	0.369	0.494	0.000
N2	-0.369	-0.494	0.000
C3	-0.369	1.754	0.000
C4	0.369	-1.754	0.000
H5	-1.455	1.600	0.000
H6	1.455	-1.600	0.000
H7	-0.063	2.323	0.883
H8	-0.063	2.323	-0.883
H9	0.063	-2.323	0.883
H10	0.063	-2.323	-0.883

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2338	1.4604	2.2476	2.1335	2.3586	2.0765	2.0765	2.9681	2.9681
N2	1.2338		2.2476	1.4604	2.3586	2.1335	2.9681	2.9681	2.0765	2.0765
C3	1.4604	2.2476		3.5843	1.0962	3.8178	1.0948	1.0948	4.1935	4.1935
C4	2.2476	1.4604	3.5843		3.8178	1.0962	4.1935	4.1935	1.0948	1.0948
H5	2.1335	2.3586	1.0962	3.8178		4.3252	1.8004	1.8004	4.2980	4.2980
H6	2.3586	2.1335	3.8178	1.0962	4.3252		4.2980	4.2980	1.8004	1.8004
H7	2.0765	2.9681	1.0948	4.1935	1.8004	4.2980		1.7664	4.6477	4.9721
H8	2.0765	2.9681	1.0948	4.1935	1.8004	4.2980	1.7664		4.9721	4.6477
H9	2.9681	2.0765	4.1935	1.0948	4.2980	1.8004	4.6477	4.9721		1.7664
H10	2.9681	2.0765	4.1935	1.0948	4.2980	1.8004	4.9721	4.6477	1.7664

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	112.805	N1	C3	H5	112.343
N1	C3	H7	107.862	N1	C3	H8	107.862
N2	N1	C3	112.805	N2	C4	H6	112.343
N2	C4	H9	107.862	N2	C4	H10	107.862
H5	C3	H7	110.519	H5	C3	H8	110.519
H6	C4	H9	110.519	H6	C4	H10	110.519
H7	C3	H8	107.560	H9	C4	H10	107.560

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

using model chemistry: wB97X-D/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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Number	Element	Mulliken
1	N	-0.183
2	N	-0.183
3	C	-0.366
4	C	-0.366
5	H	0.177
6	H	0.177
7	H	0.186
8	H	0.186
9	H	0.186
10	H	0.186

	x	y	z
x	4.522	-0.100	0.000
y	-0.100	7.834	0.000
z	0.000	0.000	4.018

<r²>	92.766
(<r²>)^1/2	9.632

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

using model chemistry: wB97X-D/6-31G*

States and conformations

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