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	hartrees
Energy at 0K	-269.659224
Energy at 298.15K	-269.668789
Nuclear repulsion energy	197.808948

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3117	3014	5.08
2	A	3056	2955	66.97
3	A	2998	2900	54.82
4	A	2989	2890	19.89
5	A	1517	1467	6.90
6	A	1506	1456	0.00
7	A	1489	1440	4.82
8	A	1470	1421	0.01
9	A	1337	1293	0.33
10	A	1213	1173	25.71
11	A	1179	1140	9.68
12	A	1135	1098	82.11
13	A	926	896	2.68
14	A	600	580	5.30
15	A	318	308	4.16
16	A	146	142	0.18
17	A	94	91	2.60
18	B	3117	3014	39.13
19	B	3055	2954	5.27
20	B	3046	2946	41.38
21	B	2990	2891	107.66
22	B	1509	1459	8.52
23	B	1489	1440	3.56
24	B	1481	1432	7.60
25	B	1431	1384	9.63
26	B	1255	1214	15.74
27	B	1178	1139	0.96
28	B	1158	1120	146.44
29	B	1060	1025	218.88
30	B	937	906	78.72
31	B	454	439	5.62
32	B	207	200	15.53
33	B	131	127	1.96

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.919
H2	-0.719	0.541	1.543
H3	0.719	-0.541	1.543
O4	0.766	0.891	0.157
O5	-0.766	-0.891	0.157
C6	0.000	1.851	-0.555
C7	0.000	-1.851	-0.555
H8	0.705	2.509	-1.057
H9	-0.705	-2.509	-1.057
H10	-0.647	1.379	-1.298
H11	-0.619	2.442	0.129
H12	0.647	-1.379	-1.298
H13	0.619	-2.442	0.129

	C1	H2	H3	O4	O5	C6	C7	H8	H9	H10	H11	H12	H13
C1		1.0946	1.0946	1.4007	1.4007	2.3663	2.3663	3.2709	3.2709	2.6898	2.6396	2.6898	2.6396
H2	1.0946		1.7993	2.0612	1.9932	2.5756	3.2616	3.5582	4.0076	2.9622	2.3707	3.6904	3.5610
H3	1.0946	1.7993		1.9932	2.0612	3.2616	2.5756	4.0076	3.5582	3.6904	3.5610	2.9622	2.3707
O4	1.4007	2.0612	1.9932		2.3499	1.4196	2.9343	2.0239	3.8985	2.0858	2.0791	2.6985	3.3358
O5	1.4007	1.9932	2.0612	2.3499		2.9343	1.4196	3.8985	2.0239	2.6985	3.3358	2.0858	2.0791
C6	2.3663	2.5756	3.2616	1.4196	2.9343		3.7015	1.0875	4.4451	1.0919	1.0956	3.3766	4.3904
C7	2.3663	3.2616	2.5756	2.9343	1.4196	3.7015		4.4451	1.0875	3.3766	4.3904	1.0919	1.0956
H8	3.2709	3.5582	4.0076	2.0239	3.8985	1.0875	4.4451		5.2130	1.7788	1.7788	3.8962	5.0917
H9	3.2709	4.0076	3.5582	3.8985	2.0239	4.4451	1.0875	5.2130		3.8962	5.0917	1.7788	1.7788
H10	2.6898	2.9622	3.6904	2.0858	2.6985	1.0919	3.3766	1.7788	3.8962		1.7793	3.0467	4.2703
H11	2.6396	2.3707	3.5610	2.0791	3.3358	1.0956	4.3904	1.7788	5.0917	1.7793		4.2703	5.0374
H12	2.6898	3.6904	2.9622	2.6985	2.0858	3.3766	1.0919	3.8962	1.7788	3.0467	4.2703		1.7793
H13	2.6396	3.5610	2.3707	3.3358	2.0791	4.3904	1.0956	5.0917	1.7788	4.2703	5.0374	1.7793

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C6	114.072	C1	O5	C7	114.072
H2	C1	H3	110.559	H2	C1	O4	110.797
H2	C1	O5	105.370	H3	C1	O4	105.370
H3	C1	O5	110.797	O4	C1	O5	114.039
O4	C6	H8	106.911	O4	C6	H10	111.635
O4	C6	H11	110.851	O5	C7	H9	106.911
O5	C7	H12	111.635	O5	C7	H13	110.851
H8	C6	H10	109.403	H8	C6	H11	109.138
H9	C7	H12	109.403	H9	C7	H13	109.138
H10	C6	H11	108.855	H12	C7	H13	108.855

All results from a given calculation for C₃H₈O₂ (Methane, dimethoxy-)

using model chemistry: B3LYP/6-311+G(3df,2p)

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	C	0.391
2	H	0.127
3	H	0.127
4	O	-0.590
5	O	-0.590
6	C	-0.145
7	C	-0.145
8	H	0.138
9	H	0.138
10	H	0.147
11	H	0.127
12	H	0.147
13	H	0.127

	x	y	z
x	6.544	-0.070	0.000
y	-0.070	8.433	0.000
z	0.000	0.000	7.133

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C3H8O2 (Methane, dimethoxy-)

using model chemistry: B3LYP/6-311+G(3df,2p)

States and conformations

All results from a given calculation for C₃H₈O₂ (Methane, dimethoxy-)