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	hartrees
Energy at 0K	-192.428368
Energy at 298.15K	-192.435402
HF Energy	-191.909211
Nuclear repulsion energy	125.333300

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3313	3061	30.15
2	A	3251	3003	35.39
3	A	3234	2988	19.87
4	A	3233	2987	8.42
5	A	3224	2978	21.63
6	A	3157	2916	15.50
7	A	1635	1510	7.22
8	A	1587	1466	5.69
9	A	1573	1453	3.94
10	A	1542	1424	17.59
11	A	1494	1380	4.11
12	A	1369	1265	4.50
13	A	1267	1170	4.27
14	A	1237	1143	3.23
15	A	1230	1136	1.50
16	A	1197	1105	8.02
17	A	1102	1018	9.19
18	A	1051	971	15.58
19	A	960	887	2.48
20	A	925	855	38.70
21	A	840	775	5.76
22	A	429	396	5.11
23	A	384	355	4.50
24	A	216	200	0.61

Atom	x (Å)	y (Å)	z (Å)
O1	0.817	-0.781	-0.246
C2	-1.501	0.102	-0.147
H3	-1.398	0.334	-1.206
H4	-2.065	-0.826	-0.054
H5	-2.071	0.898	0.334
C6	-0.149	-0.041	0.488
H7	-0.150	-0.266	1.550
C8	1.039	0.610	-0.057
H9	0.952	1.216	-0.951
H10	1.868	0.863	0.592

	O1	C2	H3	H4	H5	C6	H7	C8	H9	H10
O1		2.4827	2.6594	2.8882	3.3902	1.4205	2.1031	1.4213	2.1229	2.1239
C2	2.4827		1.0887	1.0896	1.0904	1.5010	2.2003	2.5920	2.8117	3.5325
H3	2.6594	1.0887		1.7654	1.7724	2.1376	3.0840	2.7082	2.5229	3.7657
H4	2.8882	1.0896	1.7654		1.7666	2.1405	2.5598	3.4197	3.7516	4.3286
H5	3.3902	1.0904	1.7724	1.7666		2.1446	2.5539	3.1476	3.3000	3.9476
C6	1.4205	1.5010	2.1376	2.1405	2.1446		1.0858	1.4595	2.2047	2.2123
H7	2.1031	2.2003	3.0840	2.5598	2.5539	1.0858		2.1824	3.1089	2.5027
C8	1.4213	2.5920	2.7082	3.4197	3.1476	1.4595	2.1824		1.0837	1.0833
H9	2.1229	2.8117	2.5229	3.7516	3.3000	2.2047	3.1089	1.0837		1.8293
H10	2.1239	3.5325	3.7657	4.3286	3.9476	2.2123	2.5027	1.0833	1.8293

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C6	C2	116.347	O1	C6	H7	113.421
O1	C6	C8	59.125	O1	C8	C6	59.071
O1	C8	H9	115.210	O1	C8	H10	115.330
C2	C6	H7	115.612	C2	C6	C8	122.208
H3	C2	H4	108.276	H3	C2	H5	108.854
H3	C2	C6	110.247	H4	C2	H5	108.268
H4	C2	C6	110.420	H5	C2	C6	110.708
C6	O1	C8	61.804	C6	C8	H9	119.466
C6	C8	H10	120.205	H7	C6	C8	117.300
H9	C8	H10	115.171

All results from a given calculation for C₃H₆O (Propylene oxide)

using model chemistry: CID/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 C3H6O (Propylene oxide)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for C₃H₆O (Propylene oxide)