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	hartrees
Energy at 0K	-189.197390
Energy at 298.15K	-189.204825
HF Energy	-188.932257
Nuclear repulsion energy	120.314606

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3137	2999	0.00
2	A_g	3049	2914	0.00
3	A_g	1635	1563	0.00
4	A_g	1487	1421	0.00
5	A_g	1419	1356	0.00
6	A_g	1220	1167	0.00
7	A_g	934	892	0.00
8	A_g	601	575	0.00
9	A_u	3127	2989	22.88
10	A_u	1492	1426	14.40
11	A_u	1145	1095	1.69
12	A_u	292	279	6.00
13	A_u	158	151	1.79
14	B_g	3127	2989	0.00
15	B_g	1491	1426	0.00
16	B_g	1049	1003	0.00
17	B_g	221	212	0.00
18	B_u	3137	2998	31.01
19	B_u	3048	2913	48.18
20	B_u	1495	1429	29.11
21	B_u	1423	1360	2.13
22	B_u	1146	1096	1.97
23	B_u	1035	989	7.70
24	B_u	355	339	15.02

Atom	x (Å)	y (Å)	z (Å)
N1	0.370	0.496	0.000
N2	-0.370	-0.496	0.000
C3	-0.370	1.754	0.000
C4	0.370	-1.754	0.000
H5	-1.447	1.592	0.000
H6	1.447	-1.592	0.000
H7	-0.066	2.322	0.877
H8	-0.066	2.322	-0.877
H9	0.066	-2.322	0.877
H10	0.066	-2.322	-0.877

	N1	N2	C3	C4	H5	H6	H7	H8	H9	H10
N1		1.2377	1.4595	2.2496	2.1218	2.3490	2.0721	2.0721	2.9667	2.9667
N2	1.2377		2.2496	1.4595	2.3490	2.1218	2.9667	2.9667	2.0721	2.0721
C3	1.4595	2.2496		3.5847	1.0885	3.8071	1.0883	1.0883	4.1916	4.1916
C4	2.2496	1.4595	3.5847		3.8071	1.0885	4.1916	4.1916	1.0883	1.0883
H5	2.1218	2.3490	1.0885	3.8071		4.3020	1.7909	1.7909	4.2866	4.2866
H6	2.3490	2.1218	3.8071	1.0885	4.3020		4.2866	4.2866	1.7909	1.7909
H7	2.0721	2.9667	1.0883	4.1916	1.7909	4.2866		1.7543	4.6454	4.9656
H8	2.0721	2.9667	1.0883	4.1916	1.7909	4.2866	1.7543		4.9656	4.6454
H9	2.9667	2.0721	4.1916	1.0883	4.2866	1.7909	4.6454	4.9656		1.7543
H10	2.9667	2.0721	4.1916	1.0883	4.2866	1.7909	4.9656	4.6454	1.7543

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	C4	112.777	N1	C3	H5	111.935
N1	C3	H7	107.947	N1	C3	H8	107.947
N2	N1	C3	112.777	N2	C4	H6	111.935
N2	C4	H9	107.947	N2	C4	H10	107.947
H5	C3	H7	110.717	H5	C3	H8	110.717
H6	C4	H9	110.717	H6	C4	H10	110.717
H7	C3	H8	107.406	H9	C4	H10	107.406

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

using model chemistry: B2PLYP=FULL/cc-pVTZ

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

using model chemistry: B2PLYP=FULL/cc-pVTZ

States and conformations

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