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	hartrees
Energy at 0K	-339.672057
Energy at 298.15K	-339.681083
HF Energy	-339.672057
Nuclear repulsion energy	259.675118

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3198	3068	5.84
2	A	3196	3066	2.70
3	A	3145	3017	39.79
4	A	3141	3013	0.12
5	A	3050	2926	48.55
6	A	3044	2920	24.47
7	A	1641	1574	251.26
8	A	1553	1490	32.74
9	A	1534	1472	1.37
10	A	1530	1468	8.32
11	A	1515	1454	13.67
12	A	1501	1440	30.33
13	A	1458	1399	5.34
14	A	1341	1287	268.78
15	A	1317	1264	2.08
16	A	1279	1227	2.06
17	A	1163	1115	56.36
18	A	1137	1091	3.04
19	A	1059	1016	12.45
20	A	999	958	67.14
21	A	849	815	10.82
22	A	767	736	17.85
23	A	612	587	1.40
24	A	608	583	9.42
25	A	411	394	3.82
26	A	352	338	2.17
27	A	210	201	9.99
28	A	146	140	0.41
29	A	136	131	2.72
30	A	117	112	0.03

Atom	x (Å)	y (Å)	z (Å)
O1	-1.353	-1.099	0.030
O2	-1.353	1.099	0.030
H3	1.168	-1.565	1.101
H4	2.287	-1.138	-0.226
H5	0.797	-2.049	-0.572
C6	1.238	-1.269	0.047
H7	1.167	1.565	1.102
H8	0.796	2.049	-0.572
H9	2.286	1.139	-0.226
C10	1.238	1.269	0.047
N11	-0.805	-0.000	-0.026
N12	0.560	0.000	-0.210

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.1987	2.7782	3.6491	2.4258	2.5969	3.8211	3.8591	4.2803	3.5105	1.2298	2.2198
O2	2.1987		3.8212	4.2803	3.8593	3.5105	2.7780	2.4253	3.6488	2.5966	1.2298	2.2198
H3	2.7782	3.8212		1.7882	1.7808	1.0975	3.1308	4.0002	3.2136	3.0250	2.7589	2.1305
H4	3.6491	4.2803	1.7882		1.7803	1.0914	3.2135	3.5357	2.2771	2.6402	3.3004	2.0680
H5	2.4258	3.8593	1.7808	1.7803		1.0893	4.0001	4.0979	3.5357	3.4040	2.6569	2.0940
C6	2.5969	3.5105	1.0975	1.0914	1.0893		3.0250	3.4040	2.6402	2.5381	2.4060	1.4615
H7	3.8211	2.7780	3.1308	3.2135	4.0001	3.0250		1.7809	1.7882	1.0975	2.7588	2.1305
H8	3.8591	2.4253	4.0002	3.5357	4.0979	3.4040	1.7809		1.7804	1.0894	2.6567	2.0940
H9	4.2803	3.6488	3.2136	2.2771	3.5357	2.6402	1.7882	1.7804		1.0914	3.3003	2.0679
C10	3.5105	2.5966	3.0250	2.6402	3.4040	2.5381	1.0975	1.0894	1.0914		2.4059	1.4614
N11	1.2298	1.2298	2.7589	3.3004	2.6569	2.4060	2.7588	2.6567	3.3003	2.4059		1.3774
N12	2.2198	2.2198	2.1305	2.0680	2.0940	1.4615	2.1305	2.0940	2.0679	1.4614	1.3774

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	126.734	O1	N11	N12	116.621
O2	N11	N12	116.617	H3	C6	H4	109.564
H3	C6	H5	109.045	H3	C6	N12	111.940
H4	C6	H5	109.452	H4	C6	N12	107.316
H5	C6	N12	109.488	C6	N12	C10	120.531
C6	N12	N11	115.859	H7	C10	H8	109.046
H7	C10	H9	109.565	H7	C10	N12	111.941
H8	C10	H9	109.453	H8	C10	N12	109.486
H9	C10	N12	107.314	C10	N12	N11	115.850

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: TPSSh/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	O	-0.423
2	O	-0.423
3	H	0.184
4	H	0.180
5	H	0.219
6	C	-0.341
7	H	0.184
8	H	0.219
9	H	0.180
10	C	-0.341
11	N	0.641
12	N	-0.280

	x	y	z	Total
	4.422	0.000	0.211	4.427
CHELPG
AIM
ESP

	x	y	z
x	7.727	0.000	-0.067
y	0.000	7.524	0.000
z	-0.067	0.000	4.434

<r²>	149.278
(<r²>)^1/2	12.218

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: TPSSh/6-31G*

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)