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	hartrees
Energy at 0K	-232.390747
Energy at 298.15K	-232.399301
Nuclear repulsion energy	180.302345

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3261	3140	10.10
2	A	3168	3050	1.54
3	A	3145	3028	8.58
4	A	3143	3026	37.16
5	A	3090	2975	21.98
6	A	3076	2962	51.82
7	A	3037	2923	26.76
8	A	3012	2900	58.32
9	A	1729	1664	120.92
10	A	1523	1466	10.79
11	A	1515	1458	10.40
12	A	1502	1446	12.10
13	A	1491	1435	6.53
14	A	1490	1435	10.49
15	A	1435	1381	12.01
16	A	1410	1358	29.68
17	A	1315	1266	181.65
18	A	1215	1170	0.72
19	A	1179	1135	4.63
20	A	1141	1098	107.18
21	A	1070	1030	2.03
22	A	1022	984	4.01
23	A	938	903	6.24
24	A	842	811	67.58
25	A	818	787	9.08
26	A	742	715	4.32
27	A	539	519	7.77
28	A	481	463	3.11
29	A	424	408	0.97
30	A	308	297	1.24
31	A	247	238	0.80
32	A	198	191	1.71
33	A	88	85	7.09

Atom	x (Å)	y (Å)	z (Å)
C1	1.824	-0.079	0.171
H2	1.813	0.029	1.263
H3	2.643	-0.742	-0.108
H4	1.997	0.902	-0.286
O5	0.646	-0.697	-0.304
C6	-0.589	1.411	-0.038
H7	-0.008	1.841	0.786
H8	-0.180	1.817	-0.970
H9	-1.616	1.763	0.064
C10	-0.552	-0.087	-0.040
C11	-1.628	-0.857	0.127
H12	-2.612	-0.422	0.250
H13	-1.539	-1.938	0.111

	C1	H2	H3	H4	O5	C6	H7	H8	H9	C10	C11	H12	H13
C1		1.0968	1.0898	1.0956	1.4133	2.8438	2.7245	2.9855	3.9034	2.3860	3.5389	4.4499	3.8435
H2	1.0968		1.7780	1.7873	2.0845	3.0612	2.6135	3.4863	4.0248	2.7028	3.7301	4.5614	4.0534
H3	1.0898	1.7780		1.7750	2.0075	3.8840	3.8079	3.9062	4.9435	3.2623	4.2786	5.2764	4.3553
H4	1.0956	1.7873	1.7750		2.0932	2.6469	2.4599	2.4584	3.7301	2.7452	4.0499	4.8247	4.5523
O5	1.4133	2.0845	2.0075	2.0932		2.4576	2.8386	2.7282	3.3614	1.3699	2.3194	3.3154	2.5467
C6	2.8438	3.0612	3.8840	2.6469	2.4576		1.0950	1.0957	1.0902	1.4990	2.5010	2.7457	3.4846
H7	2.7245	2.6135	3.8079	2.4599	2.8386	1.0950		1.7641	1.7636	2.1671	3.2155	3.4912	4.1327
H8	2.9855	3.4863	3.9062	2.4584	2.7282	1.0957	1.7641		1.7702	2.1512	3.2327	3.5235	4.1367
H9	3.9034	4.0248	4.9435	3.7301	3.3614	1.0902	1.7636	1.7702		2.1362	2.6209	2.4086	3.7014
C10	2.3860	2.7028	3.2623	2.7452	1.3699	1.4990	2.1671	2.1512	2.1362		1.3334	2.1065	2.1028
C11	3.5389	3.7301	4.2786	4.0499	2.3194	2.5010	3.2155	3.2327	2.6209	1.3334		1.0828	1.0839
H12	4.4499	4.5614	5.2764	4.8247	3.3154	2.7457	3.4912	3.5235	2.4086	2.1065	1.0828		1.8614
H13	3.8435	4.0534	4.3553	4.5523	2.5467	3.4846	4.1327	4.1367	3.7014	2.1028	1.0839	1.8614

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O5	C10	118.015	H2	C1	H3	108.805
H2	C1	H4	109.211	H2	C1	O5	111.667
H3	C1	H4	108.622	H3	C1	O5	105.921
H4	C1	O5	112.469	O5	C10	C6	117.811
O5	C10	C11	118.178	C6	C10	C11	123.906
H7	C6	H8	107.268	H7	C6	H9	107.619
H7	C6	C10	112.382	H8	C6	H9	108.158
H8	C6	C10	111.055	H9	C6	C10	110.185
C10	C11	H12	121.001	C10	C11	H13	120.545
H12	C11	H13	118.427

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

using model chemistry: B3PW91/6-311G*

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	C	-0.481
2	H	0.213
3	H	0.233
4	H	0.216
5	O	-0.326
6	C	-0.748
7	H	0.238
8	H	0.244
9	H	0.241
10	C	0.273
11	C	-0.536
12	H	0.211
13	H	0.222

	x	y	z	Total
	0.922	1.595	0.538	1.919
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	128.355
(<r²>)^1/2	11.329

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

using model chemistry: B3PW91/6-311G*

States and conformations

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