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	hartrees
Energy at 0K	-53.693997
Energy at 298.15K	-53.703545
Nuclear repulsion energy	113.902509

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3135	3028	5.08
2	A	3082	2976	104.84
3	A	3017	2914	74.64
4	A	3006	2903	26.55
5	A	1513	1461	6.01
6	A	1498	1447	0.15
7	A	1482	1431	4.48
8	A	1467	1416	0.74
9	A	1327	1281	1.12
10	A	1201	1160	30.12
11	A	1166	1126	7.30
12	A	1132	1093	83.87
13	A	924	893	2.74
14	A	594	573	5.60
15	A	316	306	5.72
16	A	154	149	0.25
17	A	100	97	3.34
18	B	3135	3027	82.34
19	B	3080	2975	12.56
20	B	3075	2969	58.31
21	B	3007	2904	144.57
22	B	1502	1451	5.82
23	B	1487	1436	2.81
24	B	1480	1429	10.70
25	B	1428	1379	20.61
26	B	1244	1202	10.07
27	B	1166	1126	12.12
28	B	1153	1114	176.20
29	B	1067	1031	185.54
30	B	943	911	77.98
31	B	454	438	6.02
32	B	215	208	17.98
33	B	135	130	2.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.943
H2	-0.723	0.554	1.572
H3	0.723	-0.554	1.572
O4	0.788	0.891	0.173
O5	-0.788	-0.891	0.173
C6	0.000	1.842	-0.560
C7	0.000	-1.842	-0.560
H8	0.707	2.509	-1.076
H9	-0.707	-2.509	-1.076
H10	-0.650	1.346	-1.303
H11	-0.634	2.442	0.125
H12	0.650	-1.346	-1.303
H13	0.634	-2.442	0.125

	C1	H2	H3	O4	O5	C6	C7	H8	H9	H10	H11	H12	H13
C1		1.1069	1.1069	1.4168	1.4168	2.3769	2.3769	3.2969	3.2969	2.6973	2.6520	2.6973	2.6520
H2	1.1069		1.8212	2.0861	2.0127	2.5930	3.2873	3.5885	4.0489	2.9826	2.3800	3.7091	3.5929
H3	1.1069	1.8212		2.0127	2.0861	3.2873	2.5930	4.0489	3.5885	3.7091	3.5929	2.9826	2.3800
O4	1.4168	2.0861	2.0127		2.3788	1.4354	2.9373	2.0451	3.9185	2.1096	2.1041	2.6832	3.3372
O5	1.4168	2.0127	2.0861	2.3788		2.9373	1.4354	3.9185	2.0451	2.6832	3.3372	2.1096	2.1041
C6	2.3769	2.5930	3.2873	1.4354	2.9373		3.6841	1.1007	4.4382	1.1053	1.1094	3.3371	4.3846
C7	2.3769	3.2873	2.5930	2.9373	1.4354	3.6841		4.4382	1.1007	3.3371	4.3846	1.1053	1.1094
H8	3.2969	3.5885	4.0489	2.0451	3.9185	1.1007	4.4382		5.2133	1.8019	1.8017	3.8616	5.0952
H9	3.2969	4.0489	3.5885	3.9185	2.0451	4.4382	1.1007	5.2133		3.8616	5.0952	1.8019	1.8017
H10	2.6973	2.9826	3.7091	2.1096	2.6832	1.1053	3.3371	1.8019	3.8616		1.8007	2.9888	4.2467
H11	2.6520	2.3800	3.5929	2.1041	3.3372	1.1094	4.3846	1.8017	5.0952	1.8007		4.2467	5.0459
H12	2.6973	3.7091	2.9826	2.6832	2.1096	3.3371	1.1053	3.8616	1.8019	2.9888	4.2467		1.8007
H13	2.6520	3.5929	2.3800	3.3372	2.1041	4.3846	1.1094	5.0952	1.8017	4.2467	5.0459	1.8007

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C6	112.887	C1	O5	C7	112.887
H2	C1	H3	110.710	H2	C1	O4	110.910
H2	C1	O5	105.126	H3	C1	O4	105.126
H3	C1	O5	110.910	O4	C1	O5	114.168
O4	C6	H8	106.751	O4	C6	H10	111.609
O4	C6	H11	110.899	O5	C7	H9	106.751
O5	C7	H12	111.609	O5	C7	H13	110.899
H8	C6	H10	109.536	H8	C6	H11	109.212
H9	C7	H12	109.536	H9	C7	H13	109.212
H10	C6	H11	108.790	H12	C7	H13	108.790

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

using model chemistry: B3LYP/CEP-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	C	-0.266
2	H	0.190
3	H	0.190
4	O	-0.195
5	O	-0.195
6	C	-0.404
7	C	-0.404
8	H	0.218
9	H	0.218
10	H	0.173
11	H	0.151
12	H	0.173
13	H	0.151

	x	y	z
x	4.905	0.052	0.000
y	0.052	6.698	0.000
z	0.000	0.000	5.690

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B3LYP/CEP-31G*

States and conformations

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