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	hartrees
Energy at 0K	-189.300938
Energy at 298.15K	-189.308330
HF Energy	-189.300938
Nuclear repulsion energy	119.627306

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3130	3012	0.00
2	A_g	3032	2919	0.00
3	A_g	1661	1599	0.00
4	A_g	1489	1433	0.00
5	A_g	1416	1363	0.00
6	A_g	1211	1166	0.00
7	A_g	920	885	0.00
8	A_g	585	563	0.00
9	A_u	3121	3004	26.07
10	A_u	1490	1435	17.34
11	A_u	1140	1097	2.09
12	A_u	288	277	7.70
13	A_u	163	157	2.22
14	B_g	3121	3004	0.00
15	B_g	1490	1434	0.00
16	B_g	1037	998	0.00
17	B_g	226	217	0.00
18	B_u	3129	3012	39.80
19	B_u	3031	2917	58.85
20	B_u	1495	1439	29.68
21	B_u	1421	1368	1.28
22	B_u	1139	1096	1.73
23	B_u	1018	979	9.35
24	B_u	342	329	16.02

Atom	x (Å)	y (Å)	z (Å)
N1	0.373	0.499	0.000
N2	-0.373	-0.499	0.000
C3	-0.373	1.763	0.000
C4	0.373	-1.763	0.000
H5	-1.456	1.602	0.000
H6	1.456	-1.602	0.000
H7	-0.063	2.332	0.883
H8	-0.063	2.332	-0.883
H9	0.063	-2.332	0.883
H10	0.063	-2.332	-0.883

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2453	1.4683	2.2619	2.1361	2.3634	2.0806	2.0806	2.9808	2.9808
N2	1.2453		2.2619	1.4683	2.3634	2.1361	2.9808	2.9808	2.0806	2.0806
C3	1.4683	2.2619		3.6046	1.0951	3.8302	1.0948	1.0948	4.2115	4.2115
C4	2.2619	1.4683	3.6046		3.8302	1.0951	4.2115	4.2115	1.0948	1.0948
H5	2.1361	2.3634	1.0951	3.8302		4.3297	1.8036	1.8036	4.3080	4.3080
H6	2.3634	2.1361	3.8302	1.0951	4.3297		4.3080	4.3080	1.8036	1.8036
H7	2.0806	2.9808	1.0948	4.2115	1.8036	4.3080		1.7657	4.6648	4.9878
H8	2.0806	2.9808	1.0948	4.2115	1.8036	4.3080	1.7657		4.9878	4.6648
H9	2.9808	2.0806	4.2115	1.0948	4.3080	1.8036	4.6648	4.9878		1.7657
H10	2.9808	2.0806	4.2115	1.0948	4.3080	1.8036	4.9878	4.6648	1.7657

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	112.673	N1	C3	H5	112.060
N1	C3	H7	107.649	N1	C3	H8	107.649
N2	N1	C3	112.673	N2	C4	H6	112.060
N2	C4	H9	107.649	N2	C4	H10	107.649
H5	C3	H7	110.894	H5	C3	H8	110.894
H6	C4	H9	110.894	H6	C4	H10	110.894
H7	C3	H8	107.498	H9	C4	H10	107.498

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

using model chemistry: TPSSh/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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Number	Element	Mulliken
1	N	-0.063
2	N	-0.063
3	C	-0.430
4	C	-0.430
5	H	0.166
6	H	0.166
7	H	0.164
8	H	0.164
9	H	0.164
10	H	0.164

	x	y	z
x	5.848	-0.160	0.000
y	-0.160	9.119	0.000
z	0.000	0.000	4.876

<r²>	93.939
(<r²>)^1/2	9.692

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

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

States and conformations

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