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	hartrees
Energy at 0K	-156.740436
Energy at 298.15K	-156.748064
HF Energy	-156.147424
Nuclear repulsion energy	117.336824

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3199	3039	57.03
2	A	3184	3025	0.10
3	A	3073	2920	12.87
4	A	1729	1643	3.63
5	A	1519	1443	5.62
6	A	1433	1361	4.91
7	A	1295	1230	0.03
8	A	1032	981	0.54
9	A	884	840	0.43
10	A	295	280	0.00
11	A	3138	2982	0.00
12	A	1498	1424	0.00
13	A	1059	1006	0.00
14	A	982	933	0.00
15	A	374	356	0.00
16	A	107	102	0.00
17	A	3139	2982	38.45
18	A	1505	1430	12.09
19	A	1075	1021	3.95
20	A	693	659	39.06
21	A	115	110	0.73
22	A	3181	3023	20.52
23	A	3164	3007	0.09
24	A	3070	2917	33.77
25	A	1510	1435	5.19
26	A	1448	1376	6.38
27	A	1394	1324	2.49
28	A	1165	1107	0.28
29	A	1000	950	10.63
30	A	562	534	5.53

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.672	0.668
C2	0.000	-0.672	0.668
C3	0.000	1.584	-0.526
C4	0.000	-1.584	-0.526
H5	0.000	1.169	1.638
H6	0.000	-1.169	1.638
H7	0.000	1.038	-1.470
H8	0.000	-1.038	-1.470
H9	-0.881	2.235	-0.511
H10	0.881	2.235	-0.511
H11	0.881	-2.235	-0.511
H12	-0.881	-2.235	-0.511

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.3439	1.5027	2.5525	1.0893	2.0807	2.1700	2.7382	2.1469	2.1469	3.2581	3.2581
C2	1.3439		2.5525	1.5027	2.0807	1.0893	2.7382	2.1700	3.2581	3.2581	2.1469	2.1469
C3	1.5027	2.5525		3.1678	2.2029	3.5015	1.0911	2.7864	1.0954	1.0954	3.9189	3.9189
C4	2.5525	1.5027	3.1678		3.5015	2.2029	2.7864	1.0911	3.9189	3.9189	1.0954	1.0954
H5	1.0893	2.0807	2.2029	3.5015		2.3385	3.1109	3.8118	2.5549	2.5549	4.1205	4.1205
H6	2.0807	1.0893	3.5015	2.2029	2.3385		3.8118	3.1109	4.1205	4.1205	2.5549	2.5549
H7	2.1700	2.7382	1.0911	2.7864	3.1109	3.8118		2.0751	1.7692	1.7692	3.5220	3.5220
H8	2.7382	2.1700	2.7864	1.0911	3.8118	3.1109	2.0751		3.5220	3.5220	1.7692	1.7692
H9	2.1469	3.2581	1.0954	3.9189	2.5549	4.1205	1.7692	3.5220		1.7622	4.8041	4.4692
H10	2.1469	3.2581	1.0954	3.9189	2.5549	4.1205	1.7692	3.5220	1.7622		4.4692	4.8041
H11	3.2581	2.1469	3.9189	1.0954	4.1205	2.5549	3.5220	1.7692	4.8041	4.4692		1.7622
H12	3.2581	2.1469	3.9189	1.0954	4.1205	2.5549	3.5220	1.7692	4.4692	4.8041	1.7622

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	127.362	C1	C2	H6	117.163
C1	C3	H7	112.593	C1	C3	H9	110.462
C1	C3	H10	110.462	C2	C1	C3	127.362
C2	C1	H5	117.163	C2	C4	H8	112.593
C2	C4	H11	110.462	C2	C4	H12	110.462
C3	C1	H5	115.475	C4	C2	H6	115.475
H7	C3	H9	108.018	H7	C3	H10	108.018
H8	C4	H11	108.018	H8	C4	H12	108.018
H9	C3	H10	107.089	H11	C4	H12	107.089

All results from a given calculation for CH₃CHCHCH₃ (2-Butene, (Z)-)

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

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 CH3CHCHCH3 (2-Butene, (Z)-)

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

States and conformations

All results from a given calculation for CH₃CHCHCH₃ (2-Butene, (Z)-)