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	hartrees
Energy at 0K	-688.798789
Energy at 298.15K	-688.802683
HF Energy	-687.638513
Nuclear repulsion energy	266.678870

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3345	3176	0.17
2	A'	3335	3166	1.50
3	A'	3311	3144	0.94
4	A'	1602	1521	13.51
5	A'	1516	1439	50.36
6	A'	1427	1355	13.67
7	A'	1274	1210	47.16
8	A'	1245	1182	38.03
9	A'	1180	1120	4.20
10	A'	1107	1051	9.90
11	A'	1046	994	23.36
12	A'	938	891	24.20
13	A'	897	852	2.20
14	A'	507	481	3.28
15	A'	318	302	0.41
16	A"	894	849	0.16
17	A"	829	787	26.90
18	A"	751	713	55.27
19	A"	653	620	2.77
20	A"	625	594	5.37
21	A"	234	222	1.88

Atom	x (Å)	y (Å)
C1	0.000	0.268
C2	1.304	-0.117
C3	1.277	-1.536
C4	-0.033	-1.898
O5	-0.829	-0.793
Cl6	-0.728	1.797
H7	2.153	0.534
H8	2.115	-2.202
H9	-0.544	-2.837

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3592	2.2099	2.1654	1.3465	1.6938	2.1689	3.2515	3.1515
C2	1.3592		1.4197	2.2266	2.2375	2.7911	1.0692	2.2376	3.2880
C3	2.2099	1.4197		1.3585	2.2329	3.8896	2.2474	1.0705	2.2373
C4	2.1654	2.2266	1.3585		1.3612	3.7593	3.2689	2.1692	1.0691
O5	1.3465	2.2375	2.2329	1.3612		2.5924	3.2635	3.2635	2.0630
Cl6	1.6938	2.7911	3.8896	3.7593	2.5924		3.1455	4.9066	4.6372
H7	2.1689	1.0692	2.2474	3.2689	3.2635	3.1455		2.7359	4.3160
H8	3.2515	2.2376	1.0705	2.1692	3.2635	4.9066	2.7359		2.7332
H9	3.1515	3.2880	2.2373	1.0691	2.0630	4.6372	4.3160	2.7332

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	105.337	C1	C2	H7	126.122
C1	O5	C4	106.204	C2	C1	O5	111.576
C2	C1	Cl6	131.883	C2	C3	C4	106.514
C2	C3	H8	127.384	C3	C2	H7	128.541
C3	C4	O5	110.369	C3	C4	H9	133.975
C4	C3	H8	126.102	O5	C1	Cl6	116.542
O5	C4	H9	115.656

All results from a given calculation for C₄H₃ClO (Furan, 2-chloro)

using model chemistry: MP2=FULL/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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All results from a given calculation for C4H3ClO (Furan, 2-chloro)

using model chemistry: MP2=FULL/cc-pVTZ

States and conformations

All results from a given calculation for C₄H₃ClO (Furan, 2-chloro)