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	hartrees
Energy at 0K	-189.106075
Energy at 298.15K	-189.113570
HF Energy	-189.106075
Nuclear repulsion energy	119.095015

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3179	3179	0.00
2	A_g	3079	3079	0.00
3	A_g	1681	1681	0.00
4	A_g	1524	1524	0.00
5	A_g	1460	1460	0.00
6	A_g	1235	1235	0.00
7	A_g	938	938	0.00
8	A_g	602	602	0.00
9	A_u	3178	3178	18.40
10	A_u	1527	1527	22.93
11	A_u	1170	1170	0.01
12	A_u	295	295	9.90
13	A_u	185	185	3.84
14	B_g	3178	3178	0.00
15	B_g	1526	1526	0.00
16	B_g	1078	1078	0.00
17	B_g	239	239	0.00
18	B_u	3178	3178	19.86
19	B_u	3077	3077	32.19
20	B_u	1531	1531	33.20
21	B_u	1463	1463	8.18
22	B_u	1177	1177	0.63
23	B_u	1053	1053	3.69
24	B_u	345	345	16.82

Atom	x (Å)	y (Å)	z (Å)
N1	0.369	0.506	0.000
N2	-0.369	-0.506	0.000
C3	-0.369	1.780	0.000
C4	0.369	-1.780	0.000
H5	-1.450	1.619	0.000
H6	1.450	-1.619	0.000
H7	-0.064	2.345	0.883
H8	-0.064	2.345	-0.883
H9	0.064	-2.345	0.883
H10	0.064	-2.345	-0.883

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2525	1.4731	2.2857	2.1335	2.3840	2.0858	2.0858	2.9999	2.9999
N2	1.2525		2.2857	1.4731	2.3840	2.1335	2.9999	2.9999	2.0858	2.0858
C3	1.4731	2.2857		3.6359	1.0928	3.8557	1.0921	1.0921	4.2406	4.2406
C4	2.2857	1.4731	3.6359		3.8557	1.0928	4.2406	4.2406	1.0921	1.0921
H5	2.1335	2.3840	1.0928	3.8557		4.3476	1.7971	1.7971	4.3343	4.3343
H6	2.3840	2.1335	3.8557	1.0928	4.3476		4.3343	4.3343	1.7971	1.7971
H7	2.0858	2.9999	1.0921	4.2406	1.7971	4.3343		1.7663	4.6915	5.0130
H8	2.0858	2.9999	1.0921	4.2406	1.7971	4.3343	1.7663		5.0130	4.6915
H9	2.9999	2.0858	4.2406	1.0921	4.3343	1.7971	4.6915	5.0130		1.7663
H10	2.9999	2.0858	4.2406	1.0921	4.3343	1.7971	5.0130	4.6915	1.7663

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	113.742	N1	C3	H5	111.645
N1	C3	H7	107.879	N1	C3	H8	107.879
N2	N1	C3	113.742	N2	C4	H6	111.645
N2	C4	H9	107.879	N2	C4	H10	107.879
H5	C3	H7	110.678	H5	C3	H8	110.678
H6	C4	H9	110.678	H6	C4	H10	110.678
H7	C3	H8	107.939	H9	C4	H10	107.939

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

using model chemistry: M06-2X/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	-0.213
2	N	-0.213
3	C	-0.327
4	C	-0.327
5	H	0.171
6	H	0.171
7	H	0.184
8	H	0.184
9	H	0.184
10	H	0.184

	x	y	z
x	4.381	-0.046	0.000
y	-0.046	7.809	0.000
z	0.000	0.000	3.836

<r²>	94.709
(<r²>)^1/2	9.732

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

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

States and conformations

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