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	hartrees
Energy at 0K	-154.091940
Energy at 298.15K	-154.098654
HF Energy	-154.091940
Nuclear repulsion energy	82.563849

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	3159	3028	19.42	79.97	0.34	0.51
2	A₁	3027	2902	33.71	173.54	0.04	0.07
3	A₁	1595	1529	1.27	32.13	0.75	0.86
4	A₁	1540	1477	0.73	11.35	0.72	0.84
5	A₁	1263	1210	0.06	5.41	0.64	0.78
6	A₁	927	888	20.83	13.05	0.34	0.51
7	A₁	417	400	4.61	0.39	0.02	0.05
8	A₂	3068	2941	0.00	10.71	0.75	0.86
9	A₂	1556	1492	0.00	48.90	0.75	0.86
10	A₂	1168	1120	0.00	10.48	0.75	0.86
11	A₂	237	228	0.00	0.14	0.75	0.86
12	B₁	3066	2939	110.38	78.66	0.75	0.86
13	B₁	1564	1500	18.24	1.26	0.75	0.86
14	B₁	1197	1147	2.81	4.64	0.75	0.86
15	B₁	252	241	8.49	0.04	0.75	0.86
16	B₂	3156	3026	18.07	64.95	0.75	0.86
17	B₂	3020	2896	30.39	0.85	0.75	0.86
18	B₂	1577	1512	15.73	4.14	0.75	0.86
19	B₂	1498	1437	4.49	10.33	0.75	0.86
20	B₂	1192	1143	67.03	0.01	0.75	0.86
21	B₂	1119	1073	20.50	5.88	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.613
C2	0.000	1.193	-0.206
C3	0.000	-1.193	-0.206
H4	0.000	2.041	0.479
H5	0.000	-2.041	0.479
H6	0.891	1.244	-0.847
H7	-0.891	1.244	-0.847
H8	-0.891	-1.244	-0.847
H9	0.891	-1.244	-0.847

	O1	C2	C3	H4	H5	H6	H7	H8	H9
O1		1.4466	1.4466	2.0452	2.0452	2.1151	2.1151	2.1151	2.1151
C2	1.4466		2.3852	1.0904	3.3052	1.0989	1.0989	2.6725	2.6725
C3	1.4466	2.3852		3.3052	1.0904	2.6725	2.6725	1.0989	1.0989
H4	2.0452	1.0904	3.3052		4.0816	1.7856	1.7856	3.6530	3.6530
H5	2.0452	3.3052	1.0904	4.0816		3.6530	3.6530	1.7856	1.7856
H6	2.1151	1.0989	2.6725	1.7856	3.6530		1.7817	3.0603	2.4882
H7	2.1151	1.0989	2.6725	1.7856	3.6530	1.7817		2.4882	3.0603
H8	2.1151	2.6725	1.0989	3.6530	1.7856	3.0603	2.4882		1.7817
H9	2.1151	2.6725	1.0989	3.6530	1.7856	2.4882	3.0603	1.7817

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	106.594	O1	C2	H6	111.654
O1	C2	H7	111.654	O1	C3	H5	106.594
O1	C3	H8	111.654	O1	C3	H9	111.654
C2	O1	C3	111.055	H4	C2	H6	109.290
H4	C2	H7	109.290	H5	C3	H8	109.290
H5	C3	H9	109.290	H6	C2	H7	108.315
H8	C3	H9	108.315

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

using model chemistry: M06-2X/3-21G

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	-0.516
2	C	-0.312
3	C	-0.312
4	H	0.215
5	H	0.215
6	H	0.177
7	H	0.177
8	H	0.177
9	H	0.177

<r²>	53.628
(<r²>)^1/2	7.323

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

using model chemistry: M06-2X/3-21G

States and conformations

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