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	hartrees
Energy at 0K	-689.441897
Energy at 298.15K	-689.445743
HF Energy	-689.064193
Nuclear repulsion energy	265.806638

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3315	3168	0.07
2	A'	3299	3154	0.57
3	A'	3278	3133	1.68
4	A'	1603	1532	18.69
5	A'	1515	1448	57.95
6	A'	1412	1350	14.41
7	A'	1257	1201	7.88
8	A'	1207	1154	51.61
9	A'	1152	1101	7.48
10	A'	1090	1042	15.81
11	A'	1033	987	23.27
12	A'	936	894	26.77
13	A'	900	861	2.49
14	A'	496	474	4.56
15	A'	314	300	0.45
16	A"	889	850	0.09
17	A"	822	786	22.68
18	A"	745	712	57.21
19	A"	642	614	3.18
20	A"	619	591	6.42
21	A"	228	218	1.92

Atom	x (Å)	y (Å)
C1	0.000	0.267
C2	1.305	-0.100
C3	1.294	-1.530
C4	-0.007	-1.907
O5	-0.820	-0.807
Cl6	-0.752	1.797
H7	2.151	0.558
H8	2.146	-2.183
H9	-0.508	-2.854

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3555	2.2147	2.1740	1.3520	1.7047	2.1705	3.2574	3.1621
C2	1.3555		1.4295	2.2321	2.2395	2.7982	1.0722	2.2465	3.2965
C3	2.2147	1.4295		1.3543	2.2344	3.9059	2.2568	1.0734	2.2362
C4	2.1740	2.2321	1.3543		1.3676	3.7782	3.2756	2.1700	1.0715
O5	1.3520	2.2395	2.2344	1.3676		2.6056	3.2699	3.2696	2.0700
Cl6	1.7047	2.7982	3.9059	3.7782	2.6056		3.1562	4.9236	4.6574
H7	2.1705	1.0722	2.2568	3.2756	3.2699	3.1562		2.7415	4.3255
H8	3.2574	2.2465	1.0734	2.1700	3.2696	4.9236	2.7415		2.7370
H9	3.1621	3.2965	2.2362	1.0715	2.0700	4.6574	4.3255	2.7370

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	105.318	C1	C2	H7	126.384
C1	O5	C4	106.142	C2	C1	O5	111.614
C2	C1	Cl6	131.906	C2	C3	C4	106.577
C2	C3	H8	127.095	C3	C2	H7	128.298
C3	C4	O5	110.349	C3	C4	H9	134.058
C4	C3	H8	126.328	O5	C1	Cl6	116.481
O5	C4	H9	115.593

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

using model chemistry: B2PLYP=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: B2PLYP=FULL/cc-pVTZ

States and conformations

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