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	hartrees
Energy at 0K	-722.805953
Energy at 298.15K	-722.812033
HF Energy	-722.145311
Nuclear repulsion energy	286.145744

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3205	3049	19.37
2	A	3183	3028	0.55
3	A	3183	3028	10.55
4	A	3132	2979	5.09
5	A	3107	2956	6.63
6	A	1803	1715	333.16
7	A	1608	1530	4.38
8	A	1598	1520	12.10
9	A	1589	1511	6.83
10	A	1501	1428	9.82
11	A	1436	1366	28.26
12	A	1348	1282	0.00
13	A	1212	1153	4.90
14	A	1165	1109	11.33
15	A	1126	1071	419.49
16	A	1009	960	28.27
17	A	890	847	190.14
18	A	871	828	1.19
19	A	646	614	20.53
20	A	592	563	116.50
21	A	507	483	2.60
22	A	378	360	60.54
23	A	317	301	11.02
24	A	264	251	0.77
25	A	191	182	0.46
26	A	92	87	1.87
27	A	81	77	1.30

Atom	x (Å)	y (Å)	z (Å)
O1	0.568	0.714	-0.000
H2	1.182	-1.112	-0.891
H3	1.182	-1.112	0.891
C4	1.412	-0.526	0.000
H5	3.024	0.607	-0.889
H6	3.547	-0.847	0.000
H7	3.024	0.607	0.889
C8	2.850	-0.003	0.000
O9	-1.526	1.642	0.000
Cl10	-1.479	-1.053	0.000
C11	-0.787	0.681	-0.000

	O1	H2	H3	C4	H5	H6	H7	C8	O9	Cl10	C11
O1		2.1228	2.1228	1.4999	2.6145	3.3634	2.6145	2.3923	2.2902	2.7040	1.3550
H2	2.1228		1.7830	1.0914	2.5191	2.5407	3.0849	2.1922	3.9640	2.8070	2.8087
H3	2.1228	1.7830		1.0914	3.0849	2.5407	2.5191	2.1922	3.9640	2.8070	2.8086
C4	1.4999	1.0914	1.0914		2.1613	2.1586	2.1613	1.5299	3.6512	2.9387	2.5086
H5	2.6145	2.5191	3.0849	2.1613		1.7830	1.7784	1.0922	4.7503	4.8808	3.9140
H6	3.3634	2.5407	2.5407	2.1586	1.7830		1.7830	1.0947	5.6506	5.0297	4.5954
H7	2.6145	3.0849	2.5191	2.1613	1.7784	1.7830		1.0922	4.7502	4.8808	3.9140
C8	2.3923	2.1922	2.1922	1.5299	1.0922	1.0947	1.0922		4.6751	4.4544	3.7008
O9	2.2902	3.9640	3.9640	3.6512	4.7503	5.6506	4.7502	4.6751		2.6956	1.2119
Cl10	2.7040	2.8070	2.8070	2.9387	4.8808	5.0297	4.8808	4.4544	2.6956		1.8676
C11	1.3550	2.8087	2.8086	2.5086	3.9140	4.5954	3.9140	3.7008	1.2119	1.8676

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	H2	108.985	O1	C4	H3	108.986
O1	C4	C8	104.287	O1	C11	O9	126.207
O1	C11	Cl10	113.120	H2	C4	H3	109.531
H2	C4	C8	112.422	H3	C4	C8	112.422
C4	O1	C11	122.886	C4	C8	H5	109.904
C4	C8	H6	109.547	C4	C8	H7	109.904
H5	C8	H6	109.233	H5	C8	H7	109.001
H6	C8	H7	109.233	O9	C11	Cl10	120.673

All results from a given calculation for C₃H₅ClO₂ (Carbonochloridic acid, ethyl ester)

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 C3H5ClO2 (Carbonochloridic acid, ethyl ester)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for C₃H₅ClO₂ (Carbonochloridic acid, ethyl ester)