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	hartrees
Energy at 0K	-337.756642
Energy at 298.15K	-337.766185
Nuclear repulsion energy	264.526608

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3335	3037	6.52
2	A	3331	3033	7.38
3	A	3287	2994	47.05
4	A	3276	2983	0.06
5	A	3187	2902	51.06
6	A	3180	2896	24.58
7	A	1788	1628	613.03
8	A	1628	1483	185.31
9	A	1617	1472	5.21
10	A	1599	1456	2.61
11	A	1591	1449	17.85
12	A	1582	1441	7.69
13	A	1549	1410	2.92
14	A	1526	1390	278.09
15	A	1422	1295	0.15
16	A	1401	1276	12.13
17	A	1249	1138	40.09
18	A	1212	1104	3.20
19	A	1138	1036	19.89
20	A	1135	1033	82.35
21	A	945	860	9.98
22	A	914	832	21.93
23	A	691	630	4.37
24	A	667	607	19.09
25	A	459	418	4.78
26	A	389	355	1.78
27	A	251	229	9.06
28	A	170	155	4.13
29	A	167	152	0.30
30	A	125	114	0.12

Atom	x (Å)	y (Å)	z (Å)
O1	1.335	1.060	0.037
O2	1.335	-1.060	0.037
H3	-1.162	1.501	1.117
H4	-2.260	1.129	-0.230
H5	-0.788	2.061	-0.521
C6	-1.220	1.255	0.055
H7	-1.164	-1.500	1.117
H8	-0.788	-2.061	-0.521
H9	-2.260	-1.129	-0.232
C10	-1.221	-1.254	0.055
N11	0.788	-0.000	-0.035
N12	-0.544	0.000	-0.249

	O1	O2	H3	H4	H5	C6	H7	H8	H9	C10	N11	N12
O1		2.1200	2.7566	3.6054	2.4127	2.5631	3.7371	3.8155	4.2174	3.4481	1.1948	2.1759
O2	2.1200		3.7365	4.2173	3.8157	3.4479	2.7578	2.4123	3.6056	2.5634	1.1948	2.1759
H3	2.7566	3.7365		1.7770	1.7717	1.0914	3.0007	3.9382	3.1524	2.9531	2.7178	2.1214
H4	3.6054	4.2173	1.7770		1.7664	1.0851	3.1508	3.5253	2.2577	2.6153	3.2564	2.0543
H5	2.4127	3.8157	1.7717	1.7664		1.0819	3.9380	4.1222	3.5251	3.3929	2.6399	2.0933
C6	2.5631	3.4479	1.0914	1.0851	1.0819		2.9526	3.3930	2.6158	2.5087	2.3703	1.4576
H7	3.7371	2.7578	3.0007	3.1508	3.9380	2.9526		1.7717	1.7770	1.0914	2.7185	2.1215
H8	3.8155	2.4123	3.9382	3.5253	4.1222	3.3930	1.7717		1.7664	1.0819	2.6397	2.0933
H9	4.2174	3.6056	3.1524	2.2577	3.5251	2.6158	1.7770	1.7664		1.0851	3.2565	2.0543
C10	3.4481	2.5634	2.9531	2.6153	3.3929	2.5087	1.0914	1.0819	1.0851		2.3705	1.4576
N11	1.1948	1.1948	2.7178	3.2564	2.6399	2.3703	2.7185	2.6397	3.2565	2.3705		1.3490
N12	2.1759	2.1759	2.1214	2.0543	2.0933	1.4576	2.1215	2.0933	2.0543	1.4576	1.3490

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	N11	O2	125.037	O1	N11	N12	117.469
O2	N11	N12	117.472	H3	C6	H4	109.467
H3	C6	H5	109.217	H3	C6	N12	111.867
H4	C6	H5	109.202	H4	C6	N12	106.874
H5	C6	N12	110.158	C6	N12	C10	118.766
C6	N12	N11	115.192	H7	C10	H8	109.217
H7	C10	H9	109.466	H7	C10	N12	111.867
H8	C10	H9	109.200	H8	C10	N12	110.157
H9	C10	N12	106.878	C10	N12	N11	115.205

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)

using model chemistry: HF/aug-cc-pVDZ

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	-0.761
2	O	-0.761
3	H	-0.039
4	H	-0.170
5	H	-0.130
6	C	0.881
7	H	-0.039
8	H	-0.131
9	H	-0.169
10	C	0.881
11	N	0.817
12	N	-0.378

	x	y	z	Total
	-4.788	0.001	0.204	4.793
CHELPG
AIM
ESP

<r²>	145.827
(<r²>)^1/2	12.076

All results from a given calculation for C2H6N2O2 (Dimethylnitroamine)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₂H₆N₂O₂ (Dimethylnitroamine)