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	hartrees
Energy at 0K	-687.936038
Energy at 298.15K	-687.939667
HF Energy	-687.386528
Nuclear repulsion energy	258.101257

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3305	3171	0.30
2	A'	3272	3140	0.02
3	A'	3250	3118	2.06
4	A'	1626	1560	10.59
5	A'	1529	1467	45.86
6	A'	1395	1338	9.35
7	A'	1273	1222	25.74
8	A'	1191	1143	44.86
9	A'	1132	1086	30.67
10	A'	1056	1014	14.27
11	A'	1026	984	20.08
12	A'	910	873	29.74
13	A'	895	858	9.29
14	A'	459	440	2.23
15	A'	294	282	0.44
16	A"	803	770	17.41
17	A"	778	746	10.95
18	A"	722	693	55.34
19	A"	605	580	10.42
20	A"	572	549	4.93
21	A"	216	207	3.18

Atom	x (Å)	y (Å)
C1	0.000	0.265
C2	1.330	-0.050
C3	1.396	-1.512
C4	0.106	-1.976
O5	-0.797	-0.883
Cl6	-0.866	1.831
H7	2.160	0.648
H8	2.299	-2.115
H9	-0.356	-2.955

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3666	2.2598	2.2442	1.3975	1.7887	2.1934	3.3092	3.2403
C2	1.3666		1.4630	2.2817	2.2833	2.8910	1.0848	2.2806	3.3583
C3	2.2598	1.4630		1.3708	2.2808	4.0357	2.2909	1.0861	2.2695
C4	2.2442	2.2817	1.3708		1.4179	3.9290	3.3323	2.1975	1.0824
O5	1.3975	2.2833	2.2808	1.4179		2.7143	3.3292	3.3318	2.1189
Cl6	1.7887	2.8910	4.0357	3.9290	2.7143		3.2485	5.0579	4.8130
H7	2.1934	1.0848	2.2909	3.3323	3.3292	3.2485		2.7660	4.3943
H8	3.3092	2.2806	1.0861	2.1975	3.3318	5.0579	2.7660		2.7847
H9	3.2403	3.3583	2.2695	1.0824	2.1189	4.8130	4.3943	2.7847

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	105.954	C1	C2	H7	126.575
C1	O5	C4	105.711	C2	C1	O5	111.389
C2	C1	Cl6	132.310	C2	C3	C4	107.212
C2	C3	H8	126.305	C3	C2	H7	127.471
C3	C4	O5	109.734	C3	C4	H9	135.052
C4	C3	H8	126.483	O5	C1	Cl6	116.301
O5	C4	H9	115.215

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

using model chemistry: CCD/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: CCD/6-31G

States and conformations

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