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	hartrees
Energy at 0K	-232.187361
Energy at 298.15K	-232.195917
HF Energy	-232.187361
Nuclear repulsion energy	180.274254

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3300	3151	5.82
2	A	3202	3057	0.19
3	A	3175	3032	5.96
4	A	3172	3029	27.06
5	A	3122	2981	11.80
6	A	3105	2965	42.35
7	A	3058	2919	22.48
8	A	3033	2896	61.90
9	A	1740	1661	140.38
10	A	1511	1442	9.42
11	A	1504	1436	11.83
12	A	1491	1423	8.63
13	A	1479	1412	9.16
14	A	1478	1412	13.73
15	A	1432	1367	12.49
16	A	1406	1343	46.08
17	A	1322	1262	184.21
18	A	1208	1153	0.48
19	A	1173	1120	7.69
20	A	1151	1099	95.54
21	A	1063	1015	1.58
22	A	1018	972	3.79
23	A	939	896	6.57
24	A	858	819	71.00
25	A	827	789	10.39
26	A	741	708	3.89
27	A	540	516	8.32
28	A	482	461	3.06
29	A	424	405	1.06
30	A	314	300	1.41
31	A	243	232	1.26
32	A	194	185	1.67
33	A	89	85	7.97

Atom	x (Å)	y (Å)	z (Å)
C1	1.816	0.050	0.284
H2	1.740	-0.376	1.290
H3	2.754	-0.277	-0.170
H4	1.823	1.138	0.354
O5	0.746	-0.436	-0.528
C6	-0.924	1.314	-0.009
H7	-1.221	1.570	1.010
H8	-0.136	2.003	-0.316
H9	-1.783	1.488	-0.663
C10	-0.501	-0.107	-0.104
C11	-1.352	-1.102	0.183
H12	-2.338	-0.886	0.485
H13	-1.042	-2.105	0.101

	C1	H2	H3	H4	O5	C6	H7	H8	H9	C10	C11	H12	H13
C1		1.0948	1.0916	1.0900	1.4291	3.0321	3.4734	2.8262	3.9897	2.3546	3.3728	4.2629	3.5848
H2	1.0948		1.7798	1.7814	2.0728	3.4117	3.5545	3.4291	4.4380	2.6525	3.3635	4.1876	3.4852
H3	1.0916	1.7798		1.7733	2.0457	4.0104	4.5392	3.6842	4.8924	3.2593	4.2024	5.1690	4.2216
H4	1.0900	1.7814	1.7733		2.1011	2.7761	3.1434	2.2439	3.7622	2.6754	3.8888	4.6281	4.3346
O5	1.4291	2.0728	2.0457	2.1011		2.4736	3.2027	2.6022	3.1798	1.3567	2.3127	3.2763	2.5254
C6	3.0321	3.4117	4.0104	2.7761	2.4736		1.0919	1.0908	1.0932	1.4860	2.4608	2.6610	3.4228
H7	3.4734	3.5545	4.5392	3.1434	3.2027	1.0919		1.7670	1.7665	2.1388	2.8001	2.7485	3.7904
H8	2.8262	3.4291	3.6842	2.2439	2.6022	1.0908	1.7670		1.7595	2.1521	3.3715	3.7193	4.2275
H9	3.9897	4.4380	4.8924	3.7622	3.1798	1.0932	1.7665	1.7595		2.1215	2.7583	2.6946	3.7472
C10	2.3546	2.6525	3.2593	2.6754	1.3567	1.4860	2.1388	2.1521	2.1215		1.3402	2.0802	2.0800
C11	3.3728	3.3635	4.2024	3.8888	2.3127	2.4608	2.8001	3.3715	2.7583	1.3402		1.0532	1.0532
H12	4.2629	4.1876	5.1690	4.6281	3.2763	2.6610	2.7485	3.7193	2.6946	2.0802	1.0532		1.8199
H13	3.5848	3.4852	4.2216	4.3346	2.5254	3.4228	3.7904	4.2275	3.7472	2.0800	1.0532	1.8199

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O5	C10	115.369	H2	C1	H3	108.985
H2	C1	H4	109.242	H2	C1	O5	109.721
H3	C1	H4	108.740	H3	C1	O5	107.749
H4	C1	O5	112.338	O5	C10	C6	120.885
O5	C10	C11	118.082	C6	C10	C11	120.995
H7	C6	H8	108.109	H7	C6	H9	107.894
H7	C6	C10	111.208	H8	C6	H9	107.343
H8	C6	C10	112.364	H9	C6	C10	109.745
C10	C11	H12	120.246	C10	C11	H13	120.217
H12	C11	H13	119.535

All results from a given calculation for CH₂C(CH₃)OCH₃ (1-Propene, 2-methoxy-)

using model chemistry: HSEh1PBE/6-31+G**

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	-0.244
2	H	0.158
3	H	0.171
4	H	0.153
5	O	-0.314
6	C	-0.587
7	H	0.177
8	H	0.189
9	H	0.180
10	C	0.244
11	C	-0.433
12	H	0.146
13	H	0.160

	x	y	z	Total
	0.921	1.710	0.564	2.022
CHELPG
AIM
ESP

	x	y	z
x	9.855	1.128	-0.179
y	1.128	7.988	-0.159
z	-0.179	-0.159	6.178

<r²>	128.543
(<r²>)^1/2	11.338

All results from a given calculation for CH2C(CH3)OCH3 (1-Propene, 2-methoxy-)

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

All results from a given calculation for CH₂C(CH₃)OCH₃ (1-Propene, 2-methoxy-)