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	hartrees
Energy at 0K	-192.630137
Energy at 298.15K	-192.637079
HF Energy	-191.947757
Nuclear repulsion energy	124.809929

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3248	3076	27.11
2	A	3187	3018	28.77
3	A	3170	3002	17.79
4	A	3163	2995	13.31
5	A	3146	2980	22.07
6	A	3083	2920	15.25
7	A	1570	1487	4.52
8	A	1537	1456	8.66
9	A	1521	1440	7.20
10	A	1481	1403	20.87
11	A	1437	1361	5.47
12	A	1321	1251	4.21
13	A	1213	1149	0.29
14	A	1191	1128	3.75
15	A	1171	1109	1.26
16	A	1153	1092	6.66
17	A	1064	1008	9.69
18	A	997	944	12.11
19	A	927	878	1.53
20	A	875	829	38.56
21	A	792	750	5.75
22	A	418	396	4.30
23	A	373	353	4.31
24	A	210	199	0.58

Atom	x (Å)	y (Å)	z (Å)
O1	0.823	-0.788	-0.244
C2	-1.502	0.100	-0.148
H3	-1.392	0.324	-1.210
H4	-2.068	-0.830	-0.052
H5	-2.077	0.901	0.324
C6	-0.152	-0.038	0.492
H7	-0.144	-0.262	1.558
C8	1.037	0.618	-0.060
H9	0.936	1.218	-0.961
H10	1.867	0.876	0.592

	O1	C2	H3	H4	H5	C6	H7	C8	H9	H10
O1		2.4904	2.6601	2.8968	3.4036	1.4335	2.1121	1.4346	2.1336	2.1352
C2	2.4904		1.0915	1.0926	1.0933	1.5004	2.2104	2.5927	2.8026	3.5354
H3	2.6601	1.0915		1.7695	1.7767	2.1371	3.0930	2.7036	2.5060	3.7648
H4	2.8968	1.0926	1.7695		1.7717	2.1433	2.5720	3.4256	3.7472	4.3365
H5	3.4036	1.0933	1.7767	1.7717		2.1484	2.5712	3.1501	3.2906	3.9530
C6	1.4335	1.5004	2.1371	2.1433	2.1484		1.0897	1.4656	2.2070	2.2181
H7	2.1121	2.2104	3.0930	2.5720	2.5712	1.0897		2.1882	3.1149	2.5045
C8	1.4346	2.5927	2.7036	3.4256	3.1501	1.4656	2.1882		1.0870	1.0865
H9	2.1336	2.8026	2.5060	3.7472	3.2906	2.2070	3.1149	1.0870		1.8426
H10	2.1352	3.5354	3.7648	4.3365	3.9530	2.2181	2.5045	1.0865	1.8426

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C6	C2	116.148	O1	C6	H7	112.964
O1	C6	C8	59.307	O1	C8	C6	59.233
O1	C8	H9	114.889	O1	C8	H10	115.061
C2	C6	H7	116.265	C2	C6	C8	121.884
H3	C2	H4	108.217	H3	C2	H5	108.816
H3	C2	C6	110.078	H4	C2	H5	108.286
H4	C2	C6	110.503	H5	C2	C6	110.870
C6	O1	C8	61.460	C6	C8	H9	118.932
C6	C8	H10	119.987	H7	C6	C8	117.057
H9	C8	H10	115.937

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

using model chemistry: MP2=FULL/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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All results from a given calculation for C3H6O (Propylene oxide)

using model chemistry: MP2=FULL/6-311G*

States and conformations

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