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	hartrees
Energy at 0K	-687.944074
Energy at 298.15K	-687.947674
HF Energy	-687.385489
Nuclear repulsion energy	257.599343

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3298	3178	0.11
2	A'	3264	3145	0.03
3	A'	3241	3123	2.68
4	A'	1616	1557	15.21
5	A'	1526	1470	42.66
6	A'	1384	1333	9.58
7	A'	1263	1217	13.53
8	A'	1175	1132	25.52
9	A'	1116	1075	41.41
10	A'	1038	1001	14.02
11	A'	1006	969	20.04
12	A'	898	865	24.34
13	A'	886	854	14.98
14	A'	455	438	2.59
15	A'	292	281	0.44
16	A"	802	773	18.54
17	A"	781	753	9.24
18	A"	721	695	55.92
19	A"	598	577	9.52
20	A"	570	549	5.10
21	A"	214	207	3.21

Atom	x (Å)	y (Å)
C1	0.000	0.267
C2	1.331	-0.043
C3	1.406	-1.506
C4	0.120	-1.981
O5	-0.796	-0.889
Cl6	-0.877	1.829
H7	2.159	0.660
H8	2.315	-2.102
H9	-0.338	-2.962

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3667	2.2632	2.2510	1.4040	1.7911	2.1939	3.3122	3.2468
C2	1.3667		1.4654	2.2855	2.2895	2.8946	1.0852	2.2822	3.3627
C3	2.2632	1.4654		1.3712	2.2870	4.0417	2.2925	1.0864	2.2717
C4	2.2510	2.2855	1.3712		1.4246	3.9378	3.3357	2.1982	1.0827
O5	1.4040	2.2895	2.2870	1.4246		2.7194	3.3359	3.3387	2.1227
Cl6	1.7911	2.8946	4.0417	3.9378	2.7194		3.2531	5.0635	4.8211
H7	2.1939	1.0852	2.2925	3.3357	3.3359	3.2531		2.7659	4.3984
H8	3.3122	2.2822	1.0864	2.1982	3.3387	5.0635	2.7659		2.7882
H9	3.2468	3.3627	2.2717	1.0827	2.1227	4.8211	4.3984	2.7882

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	106.041	C1	C2	H7	126.582
C1	O5	C4	105.461	C2	C1	O5	111.435
C2	C1	Cl6	132.423	C2	C3	C4	107.309
C2	C3	H8	126.206	C3	C2	H7	127.377
C3	C4	O5	109.753	C3	C4	H9	135.237
C4	C3	H8	126.485	O5	C1	Cl6	116.141
O5	C4	H9	115.009

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

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

using model chemistry: QCISD/6-31G

States and conformations

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