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	hartrees
Energy at 0K	-43.213551
Energy at 298.15K	-43.221765
Nuclear repulsion energy	96.384820

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3301	3161	26.62
2	A	3204	3068	2.34
3	A	3190	3054	53.19
4	A	3178	3043	51.89
5	A	3153	3019	33.85
6	A	3096	2965	62.87
7	A	3083	2952	27.99
8	A	3038	2909	76.58
9	A	1717	1644	144.32
10	A	1528	1463	8.59
11	A	1507	1443	7.56
12	A	1487	1424	9.33
13	A	1439	1378	31.16
14	A	1421	1361	9.42
15	A	1393	1334	39.18
16	A	1314	1258	2.88
17	A	1285	1231	0.04
18	A	1195	1144	275.84
19	A	1166	1117	6.67
20	A	1145	1097	57.34
21	A	1095	1049	18.17
22	A	985	943	6.58
23	A	966	925	47.49
24	A	884	846	94.63
25	A	828	793	3.12
26	A	824	789	4.28
27	A	687	658	7.21
28	A	473	453	1.91
29	A	418	400	3.10
30	A	237	227	0.95
31	A	192	184	0.64
32	A	88	85	6.61
33	A	44	42	0.30

Atom	x (Å)	y (Å)	z (Å)
C1	-2.494	-0.311	0.000
H2	-2.518	-1.403	0.002
H3	-3.436	0.241	-0.000
C4	-1.307	0.369	-0.001
H5	-1.254	1.466	-0.002
O6	-0.083	-0.295	-0.000
C7	1.106	0.556	0.001
H8	1.096	1.200	0.900
H9	1.096	1.203	-0.895
C10	2.327	-0.370	-0.000
H11	2.317	-1.016	0.890
H12	2.317	-1.013	-0.894
H13	3.257	0.221	0.001

	C1	H2	H3	C4	H5	O6	C7	H8	H9	C10	H11	H12	H13
C1		1.0919	1.0919	1.3676	2.1666	2.4109	3.7021	3.9978	3.9982	4.8206	4.9426	4.9430	5.7755
H2	1.0919		1.8827	2.1460	3.1347	2.6755	4.1189	4.5439	4.5456	4.9533	4.9309	4.9326	5.9992
H3	1.0919	1.8827		2.1322	2.5015	3.3952	4.5520	4.7191	4.7187	5.7945	5.9551	5.9550	6.6929
C4	1.3676	2.1460	2.1322		1.0982	1.3926	2.4200	2.6981	2.6971	3.7082	3.9807	3.9801	4.5670
H5	2.1666	3.1347	2.5015	1.0982		2.1146	2.5295	2.5319	2.5284	4.0242	4.4396	4.4377	4.6803
O6	2.4109	2.6755	3.3952	1.3926	2.1146		1.4612	2.1060	2.1060	2.4106	2.6594	2.6595	3.3797
C7	3.7021	4.1189	4.5520	2.4200	2.5295	1.4612		1.1060	1.1060	1.5323	2.1743	2.1744	2.1776
H8	3.9978	4.5439	4.7191	2.6981	2.5319	2.1060	1.1060		1.7948	2.1886	2.5302	3.0990	2.5371
H9	3.9982	4.5456	4.7187	2.6971	2.5284	2.1060	1.1060	1.7948		2.1886	3.0989	2.5301	2.5372
C10	4.8206	4.9533	5.7945	3.7082	4.0242	2.4106	1.5323	2.1886	2.1886		1.1003	1.1003	1.1026
H11	4.9426	4.9309	5.9551	3.9807	4.4396	2.6594	2.1743	2.5302	3.0989	1.1003		1.7839	1.7905
H12	4.9430	4.9326	5.9550	3.9801	4.4377	2.6595	2.1744	3.0990	2.5301	1.1003	1.7839		1.7905
H13	5.7755	5.9992	6.6929	4.5670	4.6803	3.3797	2.1776	2.5371	2.5372	1.1026	1.7905	1.7905

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	122.589	C1	C4	O6	121.717
H2	C1	H3	119.112	H2	C1	C4	121.105
H3	C1	C4	119.783	C4	O6	C7	115.971
H5	C4	O6	115.694	O6	C7	H8	109.469
O6	C7	H9	109.469	O6	C7	C10	107.252
C7	C10	H11	110.287	C7	C10	H12	110.289
C7	C10	H13	110.409	H8	C7	H9	108.472
H8	C7	C10	111.080	H9	C7	C10	111.079
H11	C10	H12	108.320	H11	C10	H13	108.740
H12	C10	H13	108.741

All results from a given calculation for C₂H₃OC₂H₅ (Ethene, ethoxy-)

using model chemistry: B1B95/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	-0.389
2	H	0.204
3	H	0.167
4	C	-0.180
5	H	0.205
6	O	-0.212
7	C	-0.233
8	H	0.140
9	H	0.140
10	C	-0.271
11	H	0.151
12	H	0.151
13	H	0.129

	x	y	z	Total
	1.133	1.917	0.001	2.226
CHELPG
AIM
ESP

	x	y	z
x	10.129	0.972	-0.001
y	0.972	5.992	-0.001
z	-0.001	-0.001	4.483

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2H3OC2H5 (Ethene, ethoxy-)

using model chemistry: B1B95/CEP-31G

States and conformations

All results from a given calculation for C₂H₃OC₂H₅ (Ethene, ethoxy-)