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	hartrees
Energy at 0K	-339.472608
Energy at 298.15K
HF Energy	-339.472608
Nuclear repulsion energy	233.515249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3479	3167	0.31	80.72	0.11	0.19
2	A₁	2069	1884	940.47	8.90	0.44	0.61
3	A₁	1836	1672	9.01	66.46	0.01	0.03
4	A₁	1307	1190	218.53	3.65	0.39	0.56
5	A₁	1225	1115	37.01	14.95	0.24	0.39
6	A₁	1012	921	23.78	8.30	0.09	0.17
7	A₁	810	738	7.85	4.24	0.30	0.47
8	A₂	988	899	0.00	6.83	0.75	0.86
9	A₂	625	569	0.00	2.08	0.75	0.86
10	B₁	902	821	8.28	0.55	0.75	0.86
11	B₁	837	762	110.19	0.01	0.75	0.86
12	B₁	251	229	0.51	0.00	0.75	0.86
13	B₂	3450	3141	12.61	44.34	0.75	0.86
14	B₂	1511	1375	61.30	0.00	0.75	0.86
15	B₂	1234	1123	134.27	0.03	0.75	0.86
16	B₂	1159	1055	8.97	2.98	0.75	0.86
17	B₂	983	895	4.02	2.09	0.75	0.86
18	B₂	583	531	0.02	1.77	0.75	0.86

Atom	y (Å)	z (Å)
C1	0.000	0.771
O2	0.000	1.937
O3	1.082	-0.013
O4	-1.082	-0.013
C5	0.653	-1.312
C6	-0.653	-1.312
H7	1.386	-2.083
H8	-1.386	-2.083

	C1	O2	O3	O4	C5	C6	H7	H8
C1		1.1660	1.3360	1.3360	2.1834	2.1834	3.1731	3.1731
O2	1.1660		2.2300	2.2300	3.3144	3.3144	4.2525	4.2525
O3	1.3360	2.2300		2.1632	1.3680	2.1674	2.0924	3.2210
O4	1.3360	2.2300	2.1632		2.1674	1.3680	3.2210	2.0924
C5	2.1834	3.3144	1.3680	2.1674		1.3066	1.0636	2.1802
C6	2.1834	3.3144	2.1674	1.3680	1.3066		2.1802	1.0636
H7	3.1731	4.2525	2.0924	3.2210	1.0636	2.1802		2.7721
H8	3.1731	4.2525	3.2210	2.0924	2.1802	1.0636	2.7721

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	C5	107.700	C1	O4	C6	107.700
O2	C1	O3	125.945	O2	C1	O4	125.945
O3	C1	O4	108.110	O3	C5	C6	108.245
O3	C5	H7	118.208	O4	C6	C5	108.245
O4	C6	H8	118.208	C5	C6	H8	133.547
C6	C5	H7	133.547

All results from a given calculation for C₃H₂O₃ (vinylene carbonate)

using model chemistry: HF/aug-cc-pVTZ

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	0.526
2	O	-0.584
3	O	-0.255
4	O	-0.255
5	C	-0.342
6	C	-0.342
7	H	0.626
8	H	0.626

<r²>	111.429
(<r²>)^1/2	10.556

All results from a given calculation for C3H2O3 (vinylene carbonate)

using model chemistry: HF/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₃H₂O₃ (vinylene carbonate)