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	hartrees
Energy at 0K	-154.990698
Energy at 298.15K	-154.997419
HF Energy	-154.990698
Nuclear repulsion energy	84.241698

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3154	3154	20.79	97.33	0.33	0.49
2	A₁	3009	3009	51.92	243.42	0.03	0.06
3	A₁	1529	1529	3.24	12.15	0.75	0.86
4	A₁	1503	1503	0.36	9.20	0.74	0.85
5	A₁	1283	1283	6.74	2.12	0.51	0.67
6	A₁	989	989	38.73	8.70	0.49	0.66
7	A₁	429	429	2.68	0.49	0.02	0.04
8	A₂	3055	3055	0.00	13.05	0.75	0.86
9	A₂	1492	1492	0.00	25.83	0.75	0.86
10	A₂	1174	1174	0.00	4.58	0.75	0.86
11	A₂	208	208	0.00	0.31	0.75	0.86
12	B₁	3051	3051	125.55	100.35	0.75	0.86
13	B₁	1502	1502	16.59	0.00	0.75	0.86
14	B₁	1206	1206	7.19	1.66	0.75	0.86
15	B₁	265	265	6.62	0.03	0.75	0.86
16	B₂	3152	3152	27.00	71.43	0.75	0.86
17	B₂	2999	2999	44.34	0.93	0.75	0.86
18	B₂	1508	1508	16.01	2.81	0.75	0.86
19	B₂	1470	1470	2.15	5.68	0.75	0.86
20	B₂	1244	1244	122.41	0.70	0.75	0.86
21	B₂	1143	1143	16.73	2.97	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.592
C2	0.000	1.162	-0.196
C3	0.000	-1.162	-0.196
H4	0.000	2.017	0.478
H5	0.000	-2.017	0.478
H6	0.891	1.210	-0.836
H7	-0.891	1.210	-0.836
H8	-0.891	-1.210	-0.836
H9	0.891	-1.210	-0.836

	O1	C2	C3	H4	H5	H6	H7	H8	H9
O1		1.4037	1.4037	2.0204	2.0204	2.0735	2.0735	2.0735	2.0735
C2	1.4037		2.3236	1.0891	3.2497	1.0985	1.0985	2.6138	2.6138
C3	1.4037	2.3236		3.2497	1.0891	2.6138	2.6138	1.0985	1.0985
H4	2.0204	1.0891	3.2497		4.0344	1.7813	1.7813	3.5972	3.5972
H5	2.0204	3.2497	1.0891	4.0344		3.5972	3.5972	1.7813	1.7813
H6	2.0735	1.0985	2.6138	1.7813	3.5972		1.7824	3.0063	2.4210
H7	2.0735	1.0985	2.6138	1.7813	3.5972	1.7824		2.4210	3.0063
H8	2.0735	2.6138	1.0985	3.5972	1.7813	3.0063	2.4210		1.7824
H9	2.0735	2.6138	1.0985	3.5972	1.7813	2.4210	3.0063	1.7824

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.616	O1	C2	H6	111.338
O1	C2	H7	111.338	O1	C3	H5	107.616
O1	C3	H8	111.338	O1	C3	H9	111.338
C2	O1	C3	111.718	H4	C2	H6	109.030
H4	C2	H7	109.030	H5	C3	H8	109.030
H5	C3	H9	109.030	H6	C2	H7	108.441
H8	C3	H9	108.441

All results from a given calculation for CH₃OCH₃ (Dimethyl ether)

using model chemistry: M06-2X/6-311G**

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	-0.368
2	C	-0.182
3	C	-0.182
4	H	0.138
5	H	0.138
6	H	0.114
7	H	0.114
8	H	0.114
9	H	0.114

<r²>	52.092
(<r²>)^1/2	7.217

All results from a given calculation for CH3OCH3 (Dimethyl ether)

using model chemistry: M06-2X/6-311G**

States and conformations

All results from a given calculation for CH₃OCH₃ (Dimethyl ether)