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	hartrees
Energy at 0K	-688.799985
Energy at 298.15K	-688.794323
HF Energy	-687.517945
Nuclear repulsion energy	267.364087

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3475	3475	0.63
2	A'	3450	3450	0.43
3	A'	3430	3430	4.06
4	A'	1780	1780	31.55
5	A'	1679	1679	78.80
6	A'	1531	1531	16.99
7	A'	1359	1359	18.73
8	A'	1311	1311	42.60
9	A'	1232	1232	14.32
10	A'	1184	1184	33.46
11	A'	1093	1093	21.75
12	A'	1019	1019	38.57
13	A'	968	968	1.87
14	A'	530	530	5.31
15	A'	338	338	0.46
16	A"	991	991	0.28
17	A"	919	919	15.82
18	A"	846	846	57.00
19	A"	704	704	5.99
20	A"	656	656	9.99
21	A"	252	252	2.30

Atom	x (Å)	y (Å)
C1	0.000	0.260
C2	1.295	-0.060
C3	1.320	-1.498
C4	0.045	-1.890
O5	-0.779	-0.820
Cl6	-0.799	1.767
H7	2.120	0.622
H8	2.183	-2.133
H9	-0.441	-2.842

	C1	C2	C3	C4	O5	Cl6	H7	H8	H9
C1		1.3340	2.1987	2.1513	1.3325	1.7054	2.1509	3.2396	3.1337
C2	1.3340		1.4383	2.2170	2.2097	2.7790	1.0705	2.2555	3.2796
C3	2.1987	1.4383		1.3347	2.2064	3.8923	2.2658	1.0715	2.2157
C4	2.1513	2.2170	1.3347		1.3508	3.7535	3.2591	2.1522	1.0684
O5	1.3325	2.2097	2.2064	1.3508		2.5873	3.2388	3.2405	2.0500
Cl6	1.7054	2.7790	3.8923	3.7535	2.5873		3.1359	4.9096	4.6229
H7	2.1509	1.0705	2.2658	3.2591	3.2388	3.1359		2.7559	4.3082
H8	3.2396	2.2555	1.0715	2.1522	3.2405	4.9096	2.7559		2.7182
H9	3.1337	3.2796	2.2157	1.0684	2.0500	4.6229	4.3082	2.7182

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	104.887	C1	C2	H7	126.549
C1	O5	C4	106.593	C2	C1	O5	111.922
C2	C1	Cl6	131.830	C2	C3	C4	106.108
C2	C3	H8	127.366	C3	C2	H7	128.564
C3	C4	O5	110.490	C3	C4	H9	134.143
C4	C3	H8	126.526	O5	C1	Cl6	116.248
O5	C4	H9	115.367

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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