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	hartrees
Energy at 0K	-154.909713
Energy at 298.15K	-154.916265
HF Energy	-154.909713
Nuclear repulsion energy	81.501996

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	3079	3055	31.21	96.98	0.33	0.49
2	A₁	2915	2893	62.98	230.93	0.03	0.06
3	A₁	1514	1502	0.53	30.03	0.74	0.85
4	A₁	1468	1457	0.12	14.41	0.68	0.81
5	A₁	1216	1207	0.00	6.46	0.69	0.82
6	A₁	827	820	21.36	10.44	0.38	0.55
7	A₁	390	387	3.39	0.83	0.11	0.20
8	A₂	2958	2936	0.00	22.59	0.75	0.86
9	A₂	1479	1468	0.00	50.41	0.75	0.86
10	A₂	1110	1102	0.00	15.92	0.75	0.86
11	A₂	221	219	0.00	0.33	0.75	0.86
12	B₁	2957	2934	178.09	104.24	0.75	0.86
13	B₁	1486	1475	12.73	0.96	0.75	0.86
14	B₁	1142	1133	2.59	5.54	0.75	0.86
15	B₁	233	231	7.77	0.01	0.75	0.86
16	B₂	3076	3053	28.09	81.36	0.75	0.86
17	B₂	2901	2879	60.45	4.21	0.75	0.86
18	B₂	1496	1485	15.57	6.03	0.75	0.86
19	B₂	1439	1428	8.58	11.92	0.75	0.86
20	B₂	1117	1108	21.72	3.90	0.75	0.86
21	B₂	1016	1008	78.15	3.89	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.611
C2	0.000	1.217	-0.207
C3	0.000	-1.217	-0.207
H4	0.000	2.056	0.502
H5	0.000	-2.056	0.502
H6	0.901	1.278	-0.851
H7	-0.901	1.278	-0.851
H8	-0.901	-1.278	-0.851
H9	0.901	-1.278	-0.851

	O1	C2	C3	H4	H5	H6	H7	H8	H9
O1		1.4659	1.4659	2.0593	2.0593	2.1400	2.1400	2.1400	2.1400
C2	1.4659		2.4337	1.0986	3.3491	1.1090	1.1090	2.7291	2.7291
C3	1.4659	2.4337		3.3491	1.0986	2.7291	2.7291	1.1090	1.1090
H4	2.0593	1.0986	3.3491		4.1128	1.8022	1.8022	3.7089	3.7089
H5	2.0593	3.3491	1.0986	4.1128		3.7089	3.7089	1.8022	1.8022
H6	2.1400	1.1090	2.7291	1.8022	3.7089		1.8017	3.1264	2.5550
H7	2.1400	1.1090	2.7291	1.8022	3.7089	1.8017		2.5550	3.1264
H8	2.1400	2.7291	1.1090	3.7089	1.8022	3.1264	2.5550		1.8017
H9	2.1400	2.7291	1.1090	3.7089	1.8022	2.5550	3.1264	1.8017

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	105.942	O1	C2	H6	111.668
O1	C2	H7	111.668	O1	C3	H5	105.942
O1	C3	H8	111.668	O1	C3	H9	111.668
C2	O1	C3	112.214	H4	C2	H6	109.435
H4	C2	H7	109.435	H5	C3	H8	109.435
H5	C3	H9	109.435	H6	C2	H7	108.640
H8	C3	H9	108.640

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

using model chemistry: BLYP/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	-0.459
2	C	-0.143
3	C	-0.143
4	H	0.145
5	H	0.145
6	H	0.114
7	H	0.114
8	H	0.114
9	H	0.114

<r²>	55.040
(<r²>)^1/2	7.419

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

using model chemistry: BLYP/6-31G

States and conformations

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