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	hartrees
Energy at 0K	-188.108442
Energy at 298.15K	-188.116039
HF Energy	-188.108442
Nuclear repulsion energy	121.350397

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3277	2964	0.00
2	A_g	3192	2886	0.00
3	A_g	1943	1758	0.00
4	A_g	1616	1462	0.00
5	A_g	1566	1416	0.00
6	A_g	1349	1220	0.00
7	A_g	1032	933	0.00
8	A_g	644	582	0.00
9	A_u	3259	2947	72.08
10	A_u	1614	1459	13.91
11	A_u	1257	1137	4.81
12	A_u	316	286	6.79
13	A_u	158	142	1.29
14	B_g	3259	2947	0.00
15	B_g	1613	1459	0.00
16	B_g	1155	1045	0.00
17	B_g	222	201	0.00
18	B_u	3277	2964	61.93
19	B_u	3189	2885	79.95
20	B_u	1621	1466	27.03
21	B_u	1562	1413	4.25
22	B_u	1257	1137	4.18
23	B_u	1140	1031	11.23
24	B_u	377	341	14.44

Atom	x (Å)	y (Å)	z (Å)
N1	0.358	0.485	0.000
N2	-0.358	-0.485	0.000
C3	-0.358	1.749	0.000
C4	0.358	-1.749	0.000
H5	-1.431	1.603	0.000
H6	1.431	-1.603	0.000
H7	-0.053	2.310	0.875
H8	-0.053	2.310	-0.875
H9	0.053	-2.310	0.875
H10	0.053	-2.310	-0.875

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2068	1.4525	2.2340	2.1102	2.3480	2.0652	2.0652	2.9453	2.9453
N2	1.2068		2.2340	1.4525	2.3480	2.1102	2.9453	2.9453	2.0652	2.0652
C3	1.4525	2.2340		3.5699	1.0828	3.7997	1.0837	1.0837	4.1724	4.1724
C4	2.2340	1.4525	3.5699		3.7997	1.0828	4.1724	4.1724	1.0837	1.0837
H5	2.1102	2.3480	1.0828	3.7997		4.2984	1.7794	1.7794	4.2759	4.2759
H6	2.3480	2.1102	3.7997	1.0828	4.2984		4.2759	4.2759	1.7794	1.7794
H7	2.0652	2.9453	1.0837	4.1724	1.7794	4.2759		1.7499	4.6218	4.9420
H8	2.0652	2.9453	1.0837	4.1724	1.7794	4.2759	1.7499		4.9420	4.6218
H9	2.9453	2.0652	4.1724	1.0837	4.2759	1.7794	4.6218	4.9420		1.7499
H10	2.9453	2.0652	4.1724	1.0837	4.2759	1.7794	4.9420	4.6218	1.7499

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	113.977	N1	C3	H5	111.854
N1	C3	H7	108.155	N1	C3	H8	108.155
N2	N1	C3	113.977	N2	C4	H6	111.854
N2	C4	H9	108.155	N2	C4	H10	108.155
H5	C3	H7	110.432	H5	C3	H8	110.432
H6	C4	H9	110.432	H6	C4	H10	110.432
H7	C3	H8	107.675	H9	C4	H10	107.675

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

using model chemistry: HF/6-311G*

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	-0.165
2	N	-0.165
3	C	-0.479
4	C	-0.479
5	H	0.206
6	H	0.206
7	H	0.219
8	H	0.219
9	H	0.219
10	H	0.219

	x	y	z
x	4.593	0.082	0.000
y	0.082	7.723	0.000
z	0.000	0.000	4.048

<r²>	92.190
(<r²>)^1/2	9.602

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

using model chemistry: HF/6-311G*

States and conformations

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