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	hartrees
Energy at 0K	-337.838062
Energy at 298.15K	-337.847543
HF Energy	-337.838062
Nuclear repulsion energy	265.286953

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3311	2996	7.47
2	A	3307	2991	7.86
3	A	3269	2958	44.43
4	A	3258	2947	0.09
5	A	3176	2873	49.05
6	A	3170	2867	25.61
7	A	1770	1601	626.33
8	A	1643	1486	103.83
9	A	1634	1478	31.55
10	A	1622	1467	3.79
11	A	1609	1455	18.79
12	A	1601	1448	6.53
13	A	1568	1418	4.09
14	A	1521	1376	352.58
15	A	1428	1291	0.69
16	A	1408	1273	14.75
17	A	1261	1141	41.47
18	A	1228	1111	2.58
19	A	1146	1036	20.91
20	A	1140	1031	83.82
21	A	948	857	9.05
22	A	925	837	22.13
23	A	691	625	3.91
24	A	673	609	20.59
25	A	457	413	4.25
26	A	387	350	1.96
27	A	239	217	7.15
28	A	164	149	0.25
29	A	149	135	4.84
30	A	129	117	0.12

Atom	x (Å)	y (Å)	z (Å)
O1	1.333	1.056	0.033
O2	1.333	-1.056	0.033
H3	-1.155	1.536	1.095
H4	-2.255	1.120	-0.221
H5	-0.799	2.043	-0.551
C6	-1.220	1.256	0.049
H7	-1.155	-1.536	1.095
H8	-0.799	-2.043	-0.551
H9	-2.255	-1.120	-0.221
C10	-1.220	-1.256	0.049
N11	0.788	0.000	-0.031
N12	-0.542	0.000	-0.220

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.1117	2.7478	3.5977	2.4217	2.5611	3.7465	3.8071	4.2040	3.4445	1.1898	2.1664
O2	2.1117		3.7465	4.2040	3.8071	3.4445	2.7477	2.4216	3.5976	2.5611	1.1898	2.1664
H3	2.7478	3.7465		1.7644	1.7587	1.0844	3.0714	3.9554	3.1613	2.9820	2.7211	2.1128
H4	3.5977	4.2040	1.7644		1.7549	1.0782	3.1613	3.4978	2.2403	2.6059	3.2485	2.0470
H5	2.4217	3.8071	1.7587	1.7549		1.0755	3.9554	4.0867	3.4978	3.3799	2.6394	2.0860
C6	2.5611	3.4445	1.0844	1.0782	1.0755		2.9820	3.3799	2.6059	2.5123	2.3703	1.4528
H7	3.7465	2.7477	3.0714	3.1613	3.9554	2.9820		1.7587	1.7644	1.0844	2.7211	2.1128
H8	3.8071	2.4216	3.9554	3.4978	4.0867	3.3799	1.7587		1.7549	1.0755	2.6394	2.0860
H9	4.2040	3.5976	3.1613	2.2403	3.4978	2.6059	1.7644	1.7549		1.0782	3.2485	2.0470
C10	3.4445	2.5611	2.9820	2.6059	3.3799	2.5123	1.0844	1.0755	1.0782		2.3703	1.4528
N11	1.1898	1.1898	2.7211	3.2485	2.6394	2.3703	2.7211	2.6394	3.2485	2.3703		1.3433
N12	2.1664	2.1664	2.1128	2.0470	2.0860	1.4528	2.1128	2.0860	2.0470	1.4528	1.3433

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	125.091	O1	N11	N12	117.447
O2	N11	N12	117.446	H3	C6	H4	109.353
H3	C6	H5	109.024	H3	C6	N12	111.944
H4	C6	H5	109.145	H4	C6	N12	107.025
H5	C6	N12	110.296	C6	N12	C10	119.679
C6	N12	N11	115.872	H7	C10	H8	109.024
H7	C10	H9	109.353	H7	C10	N12	111.944
H8	C10	H9	109.145	H8	C10	N12	110.296
H9	C10	N12	107.025	C10	N12	N11	115.871

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: HF/daug-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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Number	Element	Mulliken
1	O	-1.290
2	O	-1.290
3	H	0.616
4	H	0.479
5	H	0.570
6	C	-1.382
7	H	0.616
8	H	0.570
9	H	0.479
10	C	-1.382
11	N	1.370
12	N	0.644

	x	y	z	Total
	-4.793	0.000	0.170	4.796
CHELPG
AIM
ESP

	x	y	z
x	7.932	0.000	0.055
y	0.000	8.170	0.000
z	0.055	0.000	5.438

<r²>	145.348
(<r²>)^1/2	12.056

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: HF/daug-cc-pVTZ

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)