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	hartrees
Energy at 0K	-189.193469
Energy at 298.15K	-189.200967
HF Energy	-189.193469
Nuclear repulsion energy	120.200937

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3160	3009	0.00
2	A_g	3062	2915	0.00
3	A_g	1763	1678	0.00
4	A_g	1487	1416	0.00
5	A_g	1423	1355	0.00
6	A_g	1233	1174	0.00
7	A_g	953	908	0.00
8	A_g	612	583	0.00
9	A_u	3157	3006	17.11
10	A_u	1485	1414	20.74
11	A_u	1144	1089	1.56
12	A_u	303	288	7.27
13	A_u	180	172	2.38
14	B_g	3157	3006	0.00
15	B_g	1484	1413	0.00
16	B_g	1052	1002	0.00
17	B_g	229	218	0.00
18	B_u	3160	3009	23.90
19	B_u	3061	2914	44.57
20	B_u	1492	1420	31.11
21	B_u	1424	1356	2.26
22	B_u	1149	1094	1.26
23	B_u	1066	1015	7.38
24	B_u	359	342	15.51

Atom	x (Å)	y (Å)	z (Å)
N1	0.369	0.494	0.000
N2	-0.369	-0.494	0.000
C3	-0.369	1.757	0.000
C4	0.369	-1.757	0.000
H5	-1.450	1.595	0.000
H6	1.450	-1.595	0.000
H7	-0.060	2.324	0.882
H8	-0.060	2.324	-0.882
H9	0.060	-2.324	0.882
H10	0.060	-2.324	-0.882

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2320	1.4626	2.2504	2.1264	2.3520	2.0769	2.0769	2.9686	2.9686
N2	1.2320		2.2504	1.4626	2.3520	2.1264	2.9686	2.9686	2.0769	2.0769
C3	1.4626	2.2504		3.5901	1.0939	3.8135	1.0933	1.0933	4.1972	4.1972
C4	2.2504	1.4626	3.5901		3.8135	1.0939	4.1972	4.1972	1.0933	1.0933
H5	2.1264	2.3520	1.0939	3.8135		4.3116	1.8008	1.8008	4.2918	4.2918
H6	2.3520	2.1264	3.8135	1.0939	4.3116		4.2918	4.2918	1.8008	1.8008
H7	2.0769	2.9686	1.0933	4.1972	1.8008	4.2918		1.7646	4.6498	4.9734
H8	2.0769	2.9686	1.0933	4.1972	1.8008	4.2918	1.7646		4.9734	4.6498
H9	2.9686	2.0769	4.1972	1.0933	4.2918	1.8008	4.6498	4.9734		1.7646
H10	2.9686	2.0769	4.1972	1.0933	4.2918	1.8008	4.9734	4.6498	1.7646

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	112.982	N1	C3	H5	111.753
N1	C3	H7	107.818	N1	C3	H8	107.818
N2	N1	C3	112.982	N2	C4	H6	111.753
N2	C4	H9	107.818	N2	C4	H10	107.818
H5	C3	H7	110.839	H5	C3	H8	110.839
H6	C4	H9	110.839	H6	C4	H10	110.839
H7	C3	H8	107.605	H9	C4	H10	107.605

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

using model chemistry: M06-2X/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	-0.098
2	N	-0.098
3	C	-0.411
4	C	-0.411
5	H	0.170
6	H	0.170
7	H	0.169
8	H	0.169
9	H	0.169
10	H	0.169

	x	y	z
x	5.600	-0.025	0.000
y	-0.025	8.644	0.000
z	0.000	0.000	4.808

<r²>	93.329
(<r²>)^1/2	9.661

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

using model chemistry: M06-2X/6-31+G**

States and conformations

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