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	hartrees
Energy at 0K	-232.188614
Energy at 298.15K	-232.196904
HF Energy	-232.188614
Nuclear repulsion energy	174.198130

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3304	3154	4.58
2	A	3205	3060	0.06
3	A	3165	3022	21.33
4	A	3164	3021	22.48
5	A	3158	3015	19.58
6	A	3072	2933	16.25
7	A	3066	2928	40.58
8	A	3022	2886	59.39
9	A	1733	1655	191.29
10	A	1525	1456	8.24
11	A	1503	1435	3.33
12	A	1485	1418	8.08
13	A	1448	1383	7.69
14	A	1423	1359	68.89
15	A	1393	1330	27.69
16	A	1347	1286	8.66
17	A	1306	1247	0.59
18	A	1248	1191	283.53
19	A	1181	1127	5.06
20	A	1170	1117	115.82
21	A	1109	1059	11.48
22	A	997	952	4.51
23	A	979	934	26.14
24	A	865	826	4.23
25	A	851	813	70.94
26	A	822	785	2.32
27	A	704	672	8.24
28	A	499	477	2.86
29	A	440	420	1.61
30	A	251	240	0.47
31	A	209	199	0.27
32	A	90	86	3.73
33	A	17	17	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	-2.360	-0.315	0.200
H2	-2.288	-1.350	0.424
H3	-3.294	0.180	0.294
C4	-1.278	0.360	-0.203
H5	-1.336	1.401	-0.420
O6	-0.080	-0.243	-0.381
C7	0.989	0.443	0.278
H8	0.789	0.464	1.355
H9	1.052	1.474	-0.090
C10	2.295	-0.290	0.003
H11	2.224	-1.320	0.360
H12	2.503	-0.298	-1.068
H13	3.116	0.209	0.522

	C1	H2	H3	C4	H5	O6	C7	H8	H9	C10	H11	H12	H13
C1		1.0613	1.0606	1.3371	2.0924	2.3539	3.4344	3.4429	3.8636	4.6593	4.6953	5.0260	5.5110
H2	1.0613		1.8349	2.0821	3.0311	2.5977	3.7382	3.6908	4.4041	4.7231	4.5125	5.1277	5.6260
H3	1.0606	1.8349		2.0837	2.4155	3.3107	4.2905	4.2274	4.5507	5.6159	5.7178	5.9739	6.4142
C4	1.3371	2.0821	2.0837		1.0658	1.3527	2.3187	2.5899	2.5854	3.6373	3.9239	3.9343	4.4563
H5	2.0924	3.0311	2.4155	1.0658		2.0696	2.6094	2.9225	2.4117	4.0275	4.5476	4.2481	4.7041
O6	2.3539	2.5977	3.3107	1.3527	2.0696		1.4309	2.0656	2.0774	2.4063	2.6485	2.6739	3.3524
C7	3.4344	3.7382	4.2905	2.3187	2.6094	1.4309		1.0955	1.0964	1.5228	2.1535	2.1573	2.1543
H8	3.4429	3.6908	4.2274	2.5899	2.9225	2.0656	1.0955		1.7826	2.1599	2.4955	3.0643	2.4852
H9	3.8636	4.4041	4.5507	2.5854	2.4117	2.0774	1.0964	1.7826		2.1595	3.0622	2.4901	2.4967
C10	4.6593	4.7231	5.6159	3.6373	4.0275	2.4063	1.5228	2.1599	2.1595		1.0922	1.0908	1.0928
H11	4.6953	4.5125	5.7178	3.9239	4.5476	2.6485	2.1535	2.4955	3.0622	1.0922		1.7782	1.7780
H12	5.0260	5.1277	5.9739	3.9343	4.2481	2.6739	2.1573	3.0643	2.4901	1.0908	1.7782		1.7783
H13	5.5110	5.6260	6.4142	4.4563	4.7041	3.3524	2.1543	2.4852	2.4967	1.0928	1.7780	1.7783

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	120.686	C1	C4	O6	122.113
H2	C1	H3	119.705	H2	C1	C4	120.038
H3	C1	C4	120.257	C4	O6	C7	112.778
H5	C4	O6	117.186	O6	C7	H8	108.970
O6	C7	H9	109.854	O6	C7	C10	109.073
C7	C10	H11	109.781	C7	C10	H12	110.165
C7	C10	H13	109.808	H8	C7	H9	108.832
H8	C7	C10	110.088	H9	C7	C10	110.008
H11	C10	H12	109.084	H11	C10	H13	108.927
H12	C10	H13	109.051

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

using model chemistry: HSEh1PBE/6-31+G**

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	-0.349
2	H	0.160
3	H	0.153
4	C	0.050
5	H	0.138
6	O	-0.299
7	C	-0.041
8	H	0.153
9	H	0.153
10	C	-0.654
11	H	0.184
12	H	0.184
13	H	0.167

	x	y	z	Total
	1.244	1.413	0.000	1.883
CHELPG
AIM
ESP

	x	y	z
x	10.957	0.885	-0.000
y	0.885	7.300	-0.000
z	-0.000	-0.000	6.261

<r²>	162.067
(<r²>)^1/2	12.731

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

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

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