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	hartrees
Energy at 0K	-232.360397
Energy at 298.15K	-232.369105
Nuclear repulsion energy	180.855927

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3273	3137	10.82
2	A	3179	3047	1.44
3	A	3159	3028	5.17
4	A	3156	3026	42.64
5	A	3102	2973	20.26
6	A	3086	2959	54.61
7	A	3047	2921	26.85
8	A	3022	2897	56.34
9	A	1741	1669	123.46
10	A	1533	1470	2.87
11	A	1521	1458	15.87
12	A	1506	1443	18.85
13	A	1497	1435	3.81
14	A	1495	1433	7.37
15	A	1435	1376	15.04
16	A	1413	1355	32.53
17	A	1323	1268	178.43
18	A	1221	1170	0.56
19	A	1184	1135	7.32
20	A	1150	1102	104.94
21	A	1070	1026	1.80
22	A	1026	984	4.59
23	A	939	901	6.11
24	A	842	807	65.57
25	A	824	790	9.40
26	A	742	711	4.08
27	A	540	518	7.04
28	A	483	463	3.24
29	A	424	406	1.05
30	A	351	337	0.58
31	A	283	272	0.54
32	A	227	218	2.14
33	A	92	88	6.90

Atom	x (Å)	y (Å)	z (Å)
C1	1.815	-0.089	0.163
H2	1.812	0.043	1.250
H3	2.630	-0.755	-0.109
H4	1.978	0.881	-0.315
O5	0.634	-0.715	-0.287
C6	-0.557	1.410	-0.038
H7	0.032	1.826	0.784
H8	-0.136	1.803	-0.968
H9	-1.574	1.783	0.060
C10	-0.553	-0.085	-0.038
C11	-1.643	-0.831	0.122
H12	-2.616	-0.375	0.238
H13	-1.576	-1.911	0.108

	C1	H2	H3	H4	O5	C6	H7	H8	H9	C10	C11	H12	H13
C1		1.0950	1.0876	1.0938	1.4099	2.8127	2.6890	2.9440	3.8728	2.3760	3.5362	4.4400	3.8493
H2	1.0950		1.7753	1.7831	2.0797	3.0237	2.5627	3.4378	3.9891	2.6964	3.7382	4.5615	4.0743
H3	1.0876	1.7753		1.7732	2.0046	3.8536	3.7696	3.8649	4.9140	3.2538	4.2800	5.2712	4.3677
H4	1.0938	1.7831	1.7732		2.0868	2.6041	2.4265	2.3974	3.6839	2.7232	4.0289	4.7942	4.5393
O5	1.4099	2.0797	2.0046	2.0868		2.4490	2.8225	2.7204	3.3525	1.3667	2.3161	3.3094	2.5438
C6	2.8127	3.0237	3.8536	2.6041	2.4490		1.0931	1.0937	1.0880	1.4955	2.4960	2.7393	3.4774
H7	2.6890	2.5627	3.7696	2.4265	2.8225	1.0931		1.7604	1.7618	2.1610	3.2098	3.4859	4.1237
H8	2.9440	3.4378	3.8649	2.3974	2.7204	1.0937	1.7604		1.7677	2.1459	3.2247	3.5139	4.1266
H9	3.8728	3.9891	4.9140	3.6839	3.3525	1.0880	1.7618	1.7677		2.1316	2.6164	2.4034	3.6948
C10	2.3760	2.6964	3.2538	2.7232	1.3667	1.4955	2.1610	2.1459	2.1316		1.3303	2.1012	2.0981
C11	3.5362	3.7382	4.2800	4.0289	2.3161	2.4960	3.2098	3.2247	2.6164	1.3303		1.0808	1.0819
H12	4.4400	4.5615	5.2712	4.7942	3.3094	2.7393	3.4859	3.5139	2.4034	2.1012	1.0808		1.8592
H13	3.8493	4.0743	4.3677	4.5393	2.5438	3.4774	4.1237	4.1266	3.6948	2.0981	1.0819	1.8592

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O5	C10	117.668	H2	C1	H3	108.863
H2	C1	H4	109.107	H2	C1	O5	111.639
H3	C1	H4	108.756	H3	C1	O5	106.048
H4	C1	O5	112.303	O5	C10	C6	117.589
O5	C10	C11	118.349	C6	C10	C11	123.972
H7	C6	H8	107.222	H7	C6	H9	107.755
H7	C6	C10	112.259	H8	C6	H9	108.242
H8	C6	C10	111.002	H9	C6	C10	110.199
C10	C11	H12	120.907	C10	C11	H13	120.511
H12	C11	H13	118.557

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

using model chemistry: B1B95/6-311G*

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	-0.482
2	H	0.212
3	H	0.231
4	H	0.215
5	O	-0.318
6	C	-0.750
7	H	0.237
8	H	0.244
9	H	0.238
10	C	0.278
11	C	-0.532
12	H	0.208
13	H	0.219

	x	y	z	Total
	0.939	1.595	0.500	1.917
CHELPG
AIM
ESP

	x	y	z
x	9.338	1.023	-0.211
y	1.023	7.497	-0.146
z	-0.211	-0.146	5.139

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/6-311G*

States and conformations

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