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	hartrees
Energy at 0K	-230.152460
Energy at 298.15K	-230.160882
HF Energy	-229.671008
Nuclear repulsion energy	171.243387

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3303	3142	6.43
2	A	3210	3054	0.43
3	A	3192	3037	19.96
4	A	3179	3024	18.78
5	A	3148	2994	22.37
6	A	3106	2955	38.96
7	A	3103	2952	10.55
8	A	3057	2908	33.04
9	A	1695	1613	75.62
10	A	1622	1543	8.47
11	A	1604	1526	6.67
12	A	1589	1511	4.93
13	A	1512	1439	0.37
14	A	1494	1421	9.52
15	A	1441	1371	76.43
16	A	1386	1319	0.61
17	A	1350	1284	0.24
18	A	1223	1164	20.67
19	A	1183	1125	59.24
20	A	1159	1103	89.77
21	A	1072	1020	101.49
22	A	1016	966	29.14
23	A	984	936	11.52
24	A	883	840	63.26
25	A	875	832	1.02
26	A	833	793	6.65
27	A	732	696	2.59
28	A	488	465	1.82
29	A	422	401	3.34
30	A	260	248	1.15
31	A	220	210	1.28
32	A	86	81	0.42
33	A	70	66	5.22

Atom	x (Å)	y (Å)	z (Å)
C1	-2.468	-0.264	0.104
H2	-2.491	-1.297	0.431
H3	-3.407	0.262	-0.014
C4	-1.306	0.342	-0.173
H5	-1.256	1.382	-0.498
O6	-0.074	-0.341	-0.118
C7	1.079	0.521	0.237
H8	1.034	0.793	1.298
H9	1.058	1.442	-0.362
C10	2.326	-0.314	-0.075
H11	2.302	-1.236	0.510
H12	2.333	-0.571	-1.137
H13	3.234	0.246	0.169

	C1	H2	H3	C4	H5	O6	C7	H8	H9	C10	H11	H12	H13
C1		1.0834	1.0829	1.3389	2.1310	2.4052	3.6347	3.8481	3.9444	4.7972	4.8843	4.9677	5.7251
H2	1.0834		1.8619	2.1102	3.0927	2.6564	4.0103	4.1889	4.5522	4.9420	4.7935	5.1235	5.9351
H3	1.0829	1.8619		2.1079	2.4730	3.3885	4.5000	4.6611	4.6311	5.7619	5.9250	5.9074	6.6436
C4	1.3389	2.1102	2.1079		1.0909	1.4100	2.4268	2.8012	2.6146	3.6924	3.9970	3.8738	4.5546
H5	2.1310	3.0927	2.4730	1.0909		2.1235	2.5947	2.9693	2.3185	3.9855	4.5308	4.1354	4.6793
O6	2.4052	2.6564	3.3885	1.4100	2.1235		1.4820	2.1256	2.1256	2.4004	2.6153	2.6237	3.3721
C7	3.6347	4.0103	4.5000	2.4268	2.5947	1.4820		1.0964	1.0990	1.5327	2.1581	2.1570	2.1740
H8	3.8481	4.1889	4.6611	2.8012	2.9693	2.1256	1.0964		1.7823	2.1862	2.5193	3.0784	2.5324
H9	3.9444	4.5522	4.6311	2.6146	2.3185	2.1256	1.0990	1.7823		2.1846	3.0789	2.5057	2.5393
C10	4.7972	4.9420	5.7619	3.6924	3.9855	2.4004	1.5327	2.1862	2.1846		1.0926	1.0926	1.0947
H11	4.8843	4.7935	5.9250	3.9970	4.5308	2.6153	2.1581	2.5193	3.0789	1.0926		1.7761	1.7843
H12	4.9677	5.1235	5.9074	3.8738	4.1354	2.6237	2.1570	3.0784	2.5057	1.0926	1.7761		1.7854
H13	5.7251	5.9351	6.6436	4.5546	4.6793	3.3721	2.1740	2.5324	2.5393	1.0947	1.7843	1.7854

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	122.245	C1	C4	O6	122.063
H2	C1	H3	118.520	H2	C1	C4	120.825
H3	C1	C4	120.643	C4	O6	C7	114.075
H5	C4	O6	115.641	O6	C7	H8	110.155
O6	C7	H9	110.003	O6	C7	C10	105.531
C7	C10	H11	109.429	C7	C10	H12	109.342
C7	C10	H13	110.559	H8	C7	H9	108.554
H8	C7	C10	111.431	H9	C7	C10	111.150
H11	C10	H12	108.739	H11	C10	H13	109.322
H12	C10	H13	109.420

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

using model chemistry: MP2/3-21G*

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

using model chemistry: MP2/3-21G*

States and conformations

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