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	hartrees
Energy at 0K	-307.523629
Energy at 298.15K	-307.533012
Nuclear repulsion energy	249.390550

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3241	3101	0.40
2	A₁	3176	3039	23.17
3	A₁	3040	2908	6.32
4	A₁	1729	1654	237.76
5	A₁	1538	1472	3.69
6	A₁	1505	1440	11.48
7	A₁	1442	1380	10.09
8	A₁	1246	1192	3.26
9	A₁	1201	1149	0.64
10	A₁	907	868	39.41
11	A₁	509	487	0.29
12	A₁	270	259	4.57
13	A₂	3106	2972	0.00
14	A₂	1515	1450	0.00
15	A₂	1188	1137	0.00
16	A₂	679	649	0.00
17	A₂	249	238	0.00
18	A₂	131	125	0.00
19	B₁	3107	2972	77.18
20	B₁	1515	1449	14.56
21	B₁	1193	1141	1.30
22	B₁	720	689	98.97
23	B₁	681	651	0.94
24	B₁	272	260	0.01
25	B₁	101	97	9.34
26	B₂	3321	3177	4.98
27	B₂	3176	3038	16.41
28	B₂	3039	2908	69.77
29	B₂	1533	1467	16.19
30	B₂	1512	1447	61.67
31	B₂	1377	1317	483.28
32	B₂	1228	1175	14.94
33	B₂	1094	1047	94.96
34	B₂	959	918	0.62
35	B₂	563	538	0.20
36	B₂	384	367	8.41

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.418
C2	0.000	0.000	0.075
H3	0.000	0.923	1.981
H4	0.000	-0.923	1.981
O5	0.000	1.078	-0.735
O6	0.000	-1.078	-0.735
C7	0.000	2.346	-0.113
C8	0.000	-2.346	-0.113
H9	0.000	3.077	-0.922
H10	0.000	-3.077	-0.922
H11	-0.895	2.484	0.508
H12	0.895	2.484	0.508
H13	0.895	-2.484	0.508
H14	-0.895	-2.484	0.508

	C1	C2	H3	H4	O5	O6	C7	C8	H9	H10	H11	H12	H13	H14
C1		1.3439	1.0810	1.0810	2.4082	2.4082	2.8011	2.8011	3.8664	3.8664	2.7929	2.7929	2.7929	2.7929
C2	1.3439		2.1185	2.1185	1.3482	1.3482	2.3532	2.3532	3.2348	3.2348	2.6758	2.6758	2.6758	2.6758
H3	1.0810	2.1185		1.8455	2.7209	3.3738	2.5318	3.8818	3.6158	4.9430	2.3258	2.3258	3.8182	3.8182
H4	1.0810	2.1185	1.8455		3.3738	2.7209	3.8818	2.5318	4.9430	3.6158	3.8182	3.8182	2.3258	2.3258
O5	2.4082	1.3482	2.7209	3.3738		2.1563	1.4122	3.4800	2.0080	4.1598	2.0792	2.0792	3.8777	3.8777
O6	2.4082	1.3482	3.3738	2.7209	2.1563		3.4800	1.4122	4.1598	2.0080	3.8777	3.8777	2.0792	2.0792
C7	2.8011	2.3532	2.5318	3.8818	1.4122	3.4800		4.6915	1.0913	5.4833	1.0977	1.0977	4.9512	4.9512
C8	2.8011	2.3532	3.8818	2.5318	3.4800	1.4122	4.6915		5.4833	1.0913	4.9512	4.9512	1.0977	1.0977
H9	3.8664	3.2348	3.6158	4.9430	2.0080	4.1598	1.0913	5.4833		6.1548	1.7884	1.7884	5.8119	5.8119
H10	3.8664	3.2348	4.9430	3.6158	4.1598	2.0080	5.4833	1.0913	6.1548		5.8119	5.8119	1.7884	1.7884
H11	2.7929	2.6758	2.3258	3.8182	2.0792	3.8777	1.0977	4.9512	1.7884	5.8119		1.7893	5.2808	4.9685
H12	2.7929	2.6758	2.3258	3.8182	2.0792	3.8777	1.0977	4.9512	1.7884	5.8119	1.7893		4.9685	5.2808
H13	2.7929	2.6758	3.8182	2.3258	3.8777	2.0792	4.9512	1.0977	5.8119	1.7884	5.2808	4.9685		1.7893
H14	2.7929	2.6758	3.8182	2.3258	3.8777	2.0792	4.9512	1.0977	5.8119	1.7884	4.9685	5.2808	1.7893

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O5	126.900	C1	C2	O6	126.900
C2	C1	H3	121.391	C2	C1	H4	121.391
C2	O5	C7	116.947	C2	O6	C8	116.947
H3	C1	H4	117.218	O5	C2	O6	106.199
O5	C7	H9	105.948	O5	C7	H11	111.253
O5	C7	H12	111.253	O6	C8	H10	105.948
O6	C8	H13	111.253	O6	C8	H14	111.253
H9	C7	H11	109.572	H9	C7	H12	109.572
H10	C8	H13	109.572	H10	C8	H14	109.572
H11	C7	H12	109.186	H13	C8	H14	109.186

All results from a given calculation for C₄H₈O₂ (Ethene, 1,1-dimethoxy-)

using model chemistry: B3PW91/6-31G*

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	ESP
1	C	-0.565	-0.830
2	C	0.639	0.658
3	H	0.166	0.235
4	H	0.166	0.235
5	O	-0.465	-0.360
6	O	-0.465	-0.360
7	C	-0.281	0.023
8	C	-0.281	0.023
9	H	0.193	0.094
10	H	0.193	0.094
11	H	0.175	0.047
12	H	0.175	0.048
13	H	0.175	0.048
14	H	0.175	0.047

	x	y	z	Total
	0.000	0.000	1.167	1.167
CHELPG
AIM
ESP	0.012	0.000	1.200	1.201

<r²>	185.983
(<r²>)^1/2	13.638

All results from a given calculation for C4H8O2 (Ethene, 1,1-dimethoxy-)

using model chemistry: B3PW91/6-31G*

States and conformations

All results from a given calculation for C₄H₈O₂ (Ethene, 1,1-dimethoxy-)