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	hartrees
Energy at 0K	-232.328730
Energy at 298.15K	-232.336979
Nuclear repulsion energy	174.267438

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3300	3156	5.41
2	A	3201	3062	0.04
3	A	3163	3025	23.25
4	A	3158	3021	28.12
5	A	3157	3020	14.73
6	A	3072	2939	17.01
7	A	3065	2932	40.99
8	A	3021	2890	59.24
9	A	1732	1657	189.66
10	A	1522	1456	8.29
11	A	1500	1435	3.42
12	A	1482	1418	7.68
13	A	1442	1380	5.74
14	A	1419	1357	68.28
15	A	1388	1328	29.03
16	A	1342	1284	8.97
17	A	1301	1244	0.68
18	A	1243	1189	283.39
19	A	1176	1125	5.58
20	A	1164	1114	113.41
21	A	1104	1056	11.97
22	A	993	950	4.71
23	A	975	933	24.77
24	A	861	823	4.38
25	A	846	809	67.28
26	A	817	782	2.25
27	A	701	670	7.67
28	A	495	473	2.77
29	A	434	415	1.69
30	A	248	238	0.48
31	A	205	196	0.26
32	A	88	85	3.64
33	A	13	13	0.08

Atom	x (Å)	y (Å)	z (Å)
C1	-2.442	-0.293	0.006
H2	-2.494	-1.375	0.029
H3	-3.363	0.274	-0.004
C4	-1.275	0.347	-0.011
H5	-1.212	1.434	-0.033
O6	-0.085	-0.301	-0.007
C7	1.067	0.534	0.016
H8	1.051	1.156	0.921
H9	1.052	1.202	-0.855
C10	2.290	-0.350	-0.006
H11	2.301	-1.012	0.862
H12	2.305	-0.964	-0.908
H13	3.196	0.261	0.013

	C1	H2	H3	C4	H5	O6	C7	H8	H9	C10	H11	H12	H13
C1		1.0831	1.0814	1.3320	2.1214	2.3578	3.6060	3.8907	3.8979	4.7331	4.8735	4.8810	5.6655
H2	1.0831		1.8641	2.1105	3.0888	2.6383	4.0409	4.4459	4.4724	4.8932	4.8806	4.9070	5.9206
H3	1.0814	1.8641		2.0899	2.4443	3.3283	4.4380	4.5950	4.5918	5.6877	5.8726	5.8717	6.5590
C4	1.3320	2.1105	2.0899		1.0895	1.3546	2.3494	2.6323	2.6190	3.6322	3.9237	3.9161	4.4712
H5	2.1214	3.0888	2.4443	1.0895		2.0694	2.4511	2.4716	2.4204	3.9308	4.3740	4.3460	4.5616
O6	2.3578	2.6383	3.3283	1.3546	2.0694		1.4230	2.0668	2.0667	2.3755	2.6371	2.6387	3.3284
C7	3.6060	4.0409	4.4380	2.3494	2.4511	1.4230		1.0979	1.0980	1.5093	2.1519	2.1521	2.1461
H8	3.8907	4.4459	4.5950	2.6323	2.4716	2.0668	1.0979		1.7771	2.1592	2.5036	3.0681	2.4953
H9	3.8979	4.4724	4.5918	2.6190	2.4204	2.0667	1.0980	1.7771		2.1592	3.0680	2.5026	2.4966
C10	4.7331	4.8932	5.6877	3.6322	3.9308	2.3755	1.5093	2.1592	2.1592		1.0918	1.0919	1.0926
H11	4.8735	4.8806	5.8726	3.9237	4.3740	2.6371	2.1519	2.5036	3.0680	1.0918		1.7710	1.7730
H12	4.8810	4.9070	5.8717	3.9161	4.3460	2.6387	2.1521	3.0681	2.5026	1.0919	1.7710		1.7732
H13	5.6655	5.9206	6.5590	4.4712	4.5616	3.3284	2.1461	2.4953	2.4966	1.0926	1.7730	1.7732

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H5	122.021	C1	C4	O6	122.704
H2	C1	H3	118.907	H2	C1	C4	121.474
H3	C1	C4	119.619	C4	O6	C7	115.502
H5	C4	O6	115.274	O6	C7	H8	109.468
O6	C7	H9	109.457	O6	C7	C10	108.180
C7	C10	H11	110.618	C7	C10	H12	110.632
C7	C10	H13	110.104	H8	C7	H9	108.054
H8	C7	C10	110.835	H9	C7	C10	110.831
H11	C10	H12	108.385	H11	C10	H13	108.511
H12	C10	H13	108.525

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

using model chemistry: B1B95/6-31+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	-0.342
2	H	0.152
3	H	0.145
4	C	0.080
5	H	0.129
6	O	-0.313
7	C	-0.016
8	H	0.148
9	H	0.146
10	C	-0.642
11	H	0.177
12	H	0.177
13	H	0.160

	x	y	z	Total
	1.237	1.407	0.010	1.874
CHELPG
AIM
ESP

	x	y	z
x	10.975	0.864	-0.011
y	0.864	7.298	-0.010
z	-0.011	-0.010	6.224

<r²>	161.943
(<r²>)^1/2	12.726

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

using model chemistry: B1B95/6-31+G**

States and conformations

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