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	hartrees
Energy at 0K	-232.441637
Energy at 298.15K	-232.449893
Nuclear repulsion energy	173.638250

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3278	3150	8.16
2	A	3185	3060	0.11
3	A	3141	3018	24.40
4	A	3139	3016	27.25
5	A	3133	3010	23.57
6	A	3057	2938	15.52
7	A	3037	2918	48.42
8	A	2999	2881	55.74
9	A	1735	1667	146.94
10	A	1539	1479	9.39
11	A	1516	1456	3.14
12	A	1498	1440	4.56
13	A	1457	1400	4.33
14	A	1432	1375	48.77
15	A	1404	1349	47.94
16	A	1352	1299	4.90
17	A	1306	1255	0.21
18	A	1233	1184	234.46
19	A	1188	1141	5.39
20	A	1160	1114	125.40
21	A	1094	1051	23.70
22	A	991	952	5.08
23	A	983	944	15.13
24	A	859	826	5.12
25	A	835	802	45.70
26	A	825	793	4.91
27	A	704	677	1.86
28	A	498	479	3.27
29	A	437	420	1.37
30	A	255	245	0.60
31	A	208	200	0.31
32	A	85	82	3.10
33	A	12	11	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	-2.449	-0.296	0.011
H2	-2.495	-1.379	0.046
H3	-3.376	0.262	-0.005
C4	-1.284	0.349	-0.018
H5	-1.227	1.438	-0.053
O6	-0.085	-0.299	-0.013
C7	1.072	0.539	0.025
H8	1.061	1.150	0.939
H9	1.065	1.224	-0.835
C10	2.299	-0.354	-0.009
H11	2.305	-1.031	0.850
H12	2.311	-0.956	-0.921
H13	3.209	0.253	0.021

	C1	H2	H3	C4	H5	O6	C7	H8	H9	C10	H11	H12	H13
C1		1.0842	1.0826	1.3327	2.1222	2.3637	3.6191	3.9082	3.9213	4.7482	4.8827	4.8952	5.6847
H2	1.0842		1.8636	2.1117	3.0906	2.6416	4.0505	4.4542	4.4977	4.9028	4.8790	4.9211	5.9332
H3	1.0826	1.8636		2.0944	2.4496	3.3382	4.4571	4.6224	4.6194	5.7083	5.8885	5.8879	6.5852
C4	1.3327	2.1117	2.0944		1.0905	1.3620	2.3638	2.6558	2.6363	3.6507	3.9412	3.9295	4.4937
H5	2.1222	3.0906	2.4496	1.0905		2.0786	2.4703	2.5106	2.4318	3.9554	4.4029	4.3593	4.5925
O6	2.3637	2.6416	3.3382	1.3620	2.0786		1.4294	2.0783	2.0781	2.3849	2.6443	2.6460	3.3405
C7	3.6191	4.0505	4.4571	2.3638	2.4703	1.4294		1.0998	1.0999	1.5174	2.1596	2.1599	2.1558
H8	3.9082	4.4542	4.6224	2.6558	2.5106	2.0783	1.0998		1.7764	2.1665	2.5129	3.0759	2.5028
H9	3.9213	4.4977	4.6194	2.6363	2.4318	2.0781	1.0999	1.7764		2.1666	3.0759	2.5119	2.5044
C10	4.7482	4.9028	5.7083	3.6507	3.9554	2.3849	1.5174	2.1665	2.1666		1.0935	1.0935	1.0943
H11	4.8827	4.8790	5.8885	3.9412	4.4029	2.6443	2.1596	2.5129	3.0759	1.0935		1.7727	1.7760
H12	4.8952	4.9211	5.8879	3.9295	4.3593	2.6460	2.1599	3.0759	2.5119	1.0935	1.7727		1.7762
H13	5.6847	5.9332	6.5852	4.4937	4.5925	3.3405	2.1558	2.5028	2.5044	1.0943	1.7760	1.7762

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	121.957	C1	C4	O6	122.601
H2	C1	H3	118.650	H2	C1	C4	121.449
H3	C1	C4	119.900	C4	O6	C7	115.712
H5	C4	O6	115.441	O6	C7	H8	109.830
O6	C7	H9	109.808	O6	C7	C10	108.021
C7	C10	H11	110.565	C7	C10	H12	110.584
C7	C10	H13	110.217	H8	C7	H9	107.715
H8	C7	C10	110.735	H9	C7	C10	110.733
H11	C10	H12	108.307	H11	C10	H13	108.541
H12	C10	H13	108.560

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

using model chemistry: B3LYP/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	C	-0.300
2	H	0.100
3	H	0.095
4	C	0.217
5	H	0.081
6	O	-0.467
7	C	0.061
8	H	0.097
9	H	0.096
10	C	-0.336
11	H	0.125
12	H	0.124
13	H	0.106

	x	y	z	Total
	1.130	1.301	0.019	1.723
CHELPG
AIM
ESP

	x	y	z
x	10.182	0.801	-0.019
y	0.801	6.569	-0.053
z	-0.019	-0.053	4.635

<r²>	162.634
(<r²>)^1/2	12.753

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

using model chemistry: B3LYP/6-31G**

States and conformations

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