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	hartrees
Energy at 0K	-187.977781
Energy at 298.15K	-187.985052
HF Energy	-187.977781
Nuclear repulsion energy	117.083671

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3067	3039	0.00
2	A_g	2971	2944	0.00
3	A_g	1498	1484	0.00
4	A_g	1404	1392	0.00
5	A_g	1312	1300	0.00
6	A_g	1135	1124	0.00
7	A_g	823	815	0.00
8	A_g	565	560	0.00
9	A_u	3057	3029	22.49
10	A_u	1492	1478	19.82
11	A_u	1097	1087	0.25
12	A_u	272	270	7.73
13	A_u	169	168	5.03
14	B_g	3057	3029	0.00
15	B_g	1490	1476	0.00
16	B_g	997	988	0.00
17	B_g	226	224	0.00
18	B_u	3066	3038	27.46
19	B_u	2969	2942	31.83
20	B_u	1491	1477	29.53
21	B_u	1372	1359	8.64
22	B_u	1103	1093	1.77
23	B_u	906	898	6.39
24	B_u	330	327	16.88

Atom	x (Å)	y (Å)	z (Å)
N1	0.399	0.510	0.000
N2	-0.399	-0.510	0.000
C3	-0.399	1.790	0.000
C4	0.399	-1.790	0.000
H5	-1.485	1.593	0.000
H6	1.485	-1.593	0.000
H7	-0.100	2.365	0.893
H8	-0.100	2.365	-0.893
H9	0.100	-2.365	0.893
H10	0.100	-2.365	-0.893

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2957	1.5088	2.3005	2.1730	2.3667	2.1188	2.1188	3.0258	3.0258
N2	1.2957		2.3005	1.5088	2.3667	2.1730	3.0258	3.0258	2.1188	2.1188
C3	1.5088	2.3005		3.6687	1.1032	3.8725	1.1036	1.1036	4.2799	4.2799
C4	2.3005	1.5088	3.6687		3.8725	1.1032	4.2799	4.2799	1.1036	1.1036
H5	2.1730	2.3667	1.1032	3.8725		4.3551	1.8197	1.8197	4.3564	4.3564
H6	2.3667	2.1730	3.8725	1.1032	4.3551		4.3564	4.3564	1.8197	1.8197
H7	2.1188	3.0258	1.1036	4.2799	1.8197	4.3564		1.7867	4.7349	5.0607
H8	2.1188	3.0258	1.1036	4.2799	1.8197	4.3564	1.7867		5.0607	4.7349
H9	3.0258	2.1188	4.2799	1.1036	4.3564	1.8197	4.7349	5.0607		1.7867
H10	3.0258	2.1188	4.2799	1.1036	4.3564	1.8197	5.0607	4.7349	1.7867

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	109.997	N1	C3	H5	111.645
N1	C3	H7	107.375	N1	C3	H8	107.375
N2	N1	C3	109.997	N2	C4	H6	111.645
N2	C4	H9	107.375	N2	C4	H10	107.375
H5	C3	H7	111.086	H5	C3	H8	111.086
H6	C4	H9	111.086	H6	C4	H10	111.086
H7	C3	H8	108.086	H9	C4	H10	108.086

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

using model chemistry: PBEPBE/3-21G

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	-0.200
2	N	-0.200
3	C	-0.475
4	C	-0.475
5	H	0.215
6	H	0.215
7	H	0.230
8	H	0.230
9	H	0.230
10	H	0.230

	x	y	z
x	4.280	-0.356	0.000
y	-0.356	8.141	0.000
z	0.000	0.000	3.716

<r²>	96.215
(<r²>)^1/2	9.809

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

using model chemistry: PBEPBE/3-21G

States and conformations

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