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	hartrees
Energy at 0K	-230.934952
Energy at 298.15K	-230.940670
HF Energy	-230.707673
Nuclear repulsion energy	158.541268

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3320	3152	6.89
2	A₁	3229	3065	1.76
3	A₁	3201	3039	28.99
4	A₁	1763	1674	4.16
5	A₁	1470	1396	0.09
6	A₁	1386	1315	4.48
7	A₁	1226	1164	19.41
8	A₁	875	831	3.15
9	A₁	526	499	0.49
10	A₁	234	222	0.00
11	A₂	974	924	0.00
12	A₂	841	798	0.00
13	A₂	722	685	0.00
14	A₂	102	97	0.00
15	B₁	983	933	44.62
16	B₁	844	801	104.31
17	B₁	689	654	3.05
18	B₁	74	71	1.70
19	B₂	3320	3152	2.16
20	B₂	3228	3064	0.03
21	B₂	3194	3032	5.45
22	B₂	1718	1630	398.34
23	B₂	1459	1385	70.31
24	B₂	1357	1288	8.96
25	B₂	1239	1176	423.81
26	B₂	1048	995	7.48
27	B₂	491	466	7.19

Atom	y (Å)	z (Å)
O1	0.000	0.332
C2	1.174	-0.375
C3	-1.174	-0.375
C4	2.357	0.236
C5	-2.357	0.236
H6	1.063	-1.457
H7	-1.063	-1.457
H8	3.264	-0.351
H9	2.434	1.316
H10	-3.264	-0.351
H11	-2.434	1.316

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11
O1		1.3705	1.3705	2.3586	2.3586	2.0809	2.0809	3.3350	2.6255	3.3350	2.6255
C2	1.3705		2.3481	1.3314	3.5833	1.0876	2.4850	2.0904	2.1091	4.4384	3.9848
C3	1.3705	2.3481		3.5833	1.3314	2.4850	1.0876	4.4384	3.9848	2.0904	2.1091
C4	2.3586	1.3314	3.5833		4.7133	2.1311	3.8161	1.0813	1.0826	5.6515	4.9108
C5	2.3586	3.5833	1.3314	4.7133		3.8161	2.1311	5.6515	4.9108	1.0813	1.0826
H6	2.0809	1.0876	2.4850	2.1311	3.8161		2.1261	2.4634	3.0937	4.4664	4.4633
H7	2.0809	2.4850	1.0876	3.8161	2.1311	2.1261		4.4664	4.4633	2.4634	3.0937
H8	3.3350	2.0904	4.4384	1.0813	5.6515	2.4634	4.4664		1.8628	6.5286	5.9372
H9	2.6255	2.1091	3.9848	1.0826	4.9108	3.0937	4.4633	1.8628		5.9372	4.8679
H10	3.3350	4.4384	2.0904	5.6515	1.0813	4.4664	2.4634	6.5286	5.9372		1.8628
H11	2.6255	3.9848	2.1091	4.9108	1.0826	4.4633	3.0937	5.9372	4.8679	1.8628

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C4	121.596	O1	C2	H6	115.195
O1	C3	C5	121.596	O1	C3	H7	115.195
C2	O1	C3	117.891	C2	C4	H8	119.731
C2	C4	H9	121.445	C3	C5	H10	119.731
C3	C5	H11	121.445	C4	C2	H6	123.208
C5	C3	H7	123.208	H8	C4	H9	118.824
H10	C5	H11	118.824

All results from a given calculation for CH₂CHOCHCH₂ (Vinyl ether)

using model chemistry: B2PLYP/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	O	-0.507
2	C	0.188
3	C	0.188
4	C	-0.430
5	C	-0.430
6	H	0.159
7	H	0.159
8	H	0.164
9	H	0.174
10	H	0.164
11	H	0.174

<r²>	148.102
(<r²>)^1/2	12.170

All results from a given calculation for CH2CHOCHCH2 (Vinyl ether)

using model chemistry: B2PLYP/6-31G*

States and conformations

All results from a given calculation for CH₂CHOCHCH₂ (Vinyl ether)