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	hartrees
Energy at 0K	-270.235496
Energy at 298.15K	-270.244668
HF Energy	-269.964338
Nuclear repulsion energy	237.752987

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3282	3115	4.28
2	A	3182	3021	14.24
3	A	3163	3002	38.61
4	A	3146	2986	13.99
5	A	3112	2954	40.31
6	A	3084	2928	19.49
7	A	3084	2927	43.25
8	A	3058	2903	49.65
9	A	1752	1663	46.31
10	A	1568	1488	0.14
11	A	1547	1468	0.12
12	A	1540	1461	4.94
13	A	1521	1444	6.88
14	A	1462	1388	13.36
15	A	1432	1359	8.98
16	A	1355	1287	10.87
17	A	1297	1231	40.94
18	A	1276	1211	10.11
19	A	1234	1171	14.52
20	A	1225	1162	32.78
21	A	1108	1052	0.47
22	A	1087	1032	3.46
23	A	1058	1005	26.42
24	A	1041	988	21.29
25	A	994	943	21.89
26	A	954	905	16.32
27	A	923	876	21.39
28	A	873	829	6.40
29	A	734	696	24.58
30	A	699	664	1.49
31	A	636	604	1.26
32	A	553	525	2.67
33	A	334	317	2.11
34	A	226	215	5.89
35	A	173	165	2.39
36	A	124	118	1.81

Atom	x (Å)	y (Å)	z (Å)
C1	-1.322	-0.761	0.247
H2	-2.107	-1.444	-0.086
H3	-1.243	-0.798	1.338
O4	-0.014	-1.095	-0.259
C5	-1.495	0.711	-0.144
H6	-2.249	1.177	0.492
H7	-1.761	0.814	-1.205
C8	-0.100	1.132	0.058
H9	0.239	2.115	0.202
C10	2.159	0.014	0.056
H11	2.601	-0.376	-0.866
H12	2.543	1.020	0.229
H13	2.482	-0.632	0.878
C14	0.692	0.052	-0.036

	C1	H2	H3	O4	C5	H6	H7	C8	H9	C10	H11	H12	H13	C14
C1		1.0921	1.0945	1.4412	1.5325	2.1622	2.1866	2.2612	3.2725	3.5715	4.0954	4.2554	3.8576	2.1904
H2	1.0921		1.7862	2.1280	2.2403	2.6872	2.5435	3.2684	4.2717	4.5103	4.8893	5.2712	4.7580	3.1739
H3	1.0945	1.7862		2.0367	2.1294	2.3719	3.0546	2.5826	3.4599	3.7254	4.4508	4.3438	3.7567	2.5210
O4	1.4412	2.1280	2.0367		2.3381	3.2742	2.7552	2.2518	3.2531	2.4606	2.7792	3.3542	2.7815	1.3658
C5	1.5325	2.2403	2.1294	2.3381		1.0912	1.0982	1.4710	2.2576	3.7256	4.2984	4.0667	4.3197	2.2868
H6	2.1622	2.6872	2.3719	3.2742	1.0912		1.8021	2.1928	2.6746	4.5803	5.2704	4.8019	5.0796	3.1932
H7	2.1866	2.5435	3.0546	2.7552	1.0982	1.8021		2.1101	2.7688	4.1952	4.5337	4.5407	4.9424	2.8223
C8	2.2612	3.2684	2.5826	2.2518	1.4710	2.1928	2.1101		1.0493	2.5215	3.2287	2.6510	3.2330	1.3433
H9	3.2725	4.2717	3.4599	3.2531	2.2576	2.6746	2.7688	1.0493		2.8509	3.5954	2.5516	3.6107	2.1258
C10	3.5715	4.5103	3.7254	2.4606	3.7256	4.5803	4.1952	2.5215	2.8509		1.0942	1.0905	1.0937	1.4705
H11	4.0954	4.8893	4.4508	2.7792	4.2984	5.2704	4.5337	3.2287	3.5954	1.0942		1.7751	1.7667	2.1247
H12	4.2554	5.2712	4.3438	3.3542	4.0667	4.8019	4.5407	2.6510	2.5516	1.0905	1.7751		1.7762	2.1050
H13	3.8576	4.7580	3.7567	2.7815	4.3197	5.0796	4.9424	3.2330	3.6107	1.0937	1.7667	1.7762		2.1223
C14	2.1904	3.1739	2.5210	1.3658	2.2868	3.1932	2.8223	1.3433	2.1258	1.4705	2.1247	2.1050	2.1223

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	C14	102.552	C1	C5	H6	109.853
C1	C5	H7	111.367	C1	C5	C8	97.660
H2	C1	H3	109.548	H2	C1	O4	113.572
H2	C1	C5	116.198	H3	C1	O4	106.069
H3	C1	C5	107.127	O4	C1	C5	103.632
O4	C14	C8	112.440	O4	C14	C10	120.303
C5	C8	H9	126.396	C5	C8	C14	108.616
H6	C5	H7	110.793	H6	C5	C8	116.933
H7	C5	C8	109.578	C8	C14	C10	127.250
H9	C8	C14	124.917	H11	C10	H12	108.678
H11	C10	H13	107.705	H11	C10	C14	111.025
H12	C10	H13	108.818	H12	C10	C14	109.673
H13	C10	C14	110.873

All results from a given calculation for C₅H₈O (Furan, 2,3-dihydro-5-methyl-)

using model chemistry: B2PLYP/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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Number	Element	Mulliken
1	C	-0.019
2	H	0.161
3	H	0.155
4	O	-0.572
5	C	-0.339
6	H	0.158
7	H	0.160
8	C	-0.277
9	H	0.153
10	C	-0.523
11	H	0.179
12	H	0.169
13	H	0.178
14	C	0.418

	x	y	z
x	9.407	-0.506	0.017
y	-0.506	8.095	0.019
z	0.017	0.019	5.652

<r²>	156.220
(<r²>)^1/2	12.499

All results from a given calculation for C5H8O (Furan, 2,3-dihydro-5-methyl-)

using model chemistry: B2PLYP/6-31G*

States and conformations

All results from a given calculation for C₅H₈O (Furan, 2,3-dihydro-5-methyl-)