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	hartrees
Energy at 0K	-231.225061
Energy at 298.15K	-231.232301
Nuclear repulsion energy	174.990399

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3277	3135	6.17
2	A	3248	3108	2.28
3	A	3139	3003	33.43
4	A	3094	2960	31.77
5	A	3059	2926	44.36
6	A	3035	2904	43.72
7	A	1702	1628	61.86
8	A	1521	1455	1.30
9	A	1496	1432	0.90
10	A	1416	1354	3.99
11	A	1333	1275	2.08
12	A	1308	1251	7.24
13	A	1254	1200	10.30
14	A	1219	1166	19.36
15	A	1176	1126	73.75
16	A	1107	1059	34.67
17	A	1076	1029	5.35
18	A	1026	981	9.47
19	A	961	919	24.54
20	A	950	909	32.93
21	A	932	892	3.61
22	A	856	819	1.42
23	A	844	807	7.04
24	A	728	697	42.71
25	A	688	658	1.54
26	A	462	442	23.22
27	A	119	113	1.42

Atom	x (Å)	y (Å)	z (Å)
H1	1.002	2.085	0.101
C2	0.547	1.109	0.054
H3	2.254	-0.254	0.024
C4	1.193	-0.051	0.010
O5	0.408	-1.155	-0.084
H6	-1.313	1.152	-1.050
H7	-1.534	1.323	0.689
C8	-0.929	0.831	-0.075
H9	-1.570	-1.216	-0.644
H10	-1.269	-0.988	1.092
C11	-0.950	-0.699	0.087

	H1	C2	H3	C4	O5	H6	H7	C8	H9	H10	C11
H1		1.0784	2.6544	2.1465	3.2989	2.7487	2.7128	2.3093	4.2508	3.9478	3.3999
C2	1.0784		2.1847	1.3282	2.2716	2.1633	2.1865	1.5070	3.2206	2.9619	2.3468
H3	2.6544	2.1847		1.0806	2.0573	3.9821	4.1571	3.3641	3.9992	3.7543	3.2355
C4	2.1465	1.3282	1.0806		1.3578	2.9754	3.1282	2.2990	3.0689	2.8480	2.2400
O5	3.2989	2.2716	2.0573	1.3578		3.0358	3.2412	2.3929	2.0559	2.0548	1.4422
H6	2.7487	2.1633	3.9821	2.9754	3.0358		1.7617	1.0963	2.4171	3.0288	2.2024
H7	2.7128	2.1865	4.1571	3.1282	3.2412	1.7617		1.0925	2.8684	2.3608	2.1887
C8	2.3093	1.5070	3.3641	2.2990	2.3929	1.0963	1.0925		2.2192	2.1878	1.5378
H9	4.2508	3.2206	3.9992	3.0689	2.0559	2.4171	2.8684	2.2192		1.7769	1.0892
H10	3.9478	2.9619	3.7543	2.8480	2.0548	3.0288	2.3608	2.1878	1.7769		1.0939
C11	3.3999	2.3468	3.2355	2.2400	1.4422	2.2024	2.1887	1.5378	1.0892	1.0939

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	125.919	H1	C2	C8	125.745
C2	C4	H3	129.903	C2	C4	O5	115.498
C2	C8	H6	111.422	C2	C8	H7	113.552
C2	C8	C11	100.841	H3	C4	O5	114.592
C4	C2	C8	108.201	C4	O5	C11	106.221
O5	C11	C8	106.788	O5	C11	H9	107.797
O5	C11	H10	107.442	H6	C8	H7	107.196
H6	C8	C11	112.385	H7	C8	C11	111.511
C8	C11	H9	114.207	C8	C11	H10	111.354
H9	C11	H10	108.961

All results from a given calculation for C₄H₆O (Furan, 2,3-dihydro-)

using model chemistry: mPW1PW91/6-311G**

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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Number	Element	Mulliken
1	H	0.112
2	C	-0.267
3	H	0.120
4	C	0.118
5	O	-0.332
6	H	0.139
7	H	0.138
8	C	-0.262
9	H	0.130
10	H	0.130
11	C	-0.026

	x	y	z	Total
	-0.748	0.884	0.124	1.164
CHELPG
AIM
ESP

	x	y	z
x	7.252	-0.230	0.046
y	-0.230	7.295	-0.021
z	0.046	-0.021	4.773

<r²>	93.385
(<r²>)^1/2	9.664

All results from a given calculation for C4H6O (Furan, 2,3-dihydro-)

using model chemistry: mPW1PW91/6-311G**

States and conformations

All results from a given calculation for C₄H₆O (Furan, 2,3-dihydro-)