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	hartrees
Energy at 0K	-156.716349
Energy at 298.15K	-156.723969
HF Energy	-156.123854
Nuclear repulsion energy	117.580757

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3248	3051	60.08
2	A	3234	3038	0.56
3	A	3118	2928	15.77
4	A	1748	1641	5.99
5	A	1547	1453	6.10
6	A	1464	1375	4.54
7	A	1320	1240	0.09
8	A	1053	989	0.33
9	A	893	838	0.55
10	A	300	282	0.00
11	A	3190	2996	0.00
12	A	1522	1429	0.00
13	A	1070	1005	0.00
14	A	991	931	0.00
15	A	371	349	0.00
16	A	101	95	0.00
17	A	3190	2996	33.13
18	A	1530	1437	12.45
19	A	1091	1025	7.12
20	A	700	657	46.76
21	A	106	99	1.11
22	A	3232	3035	19.44
23	A	3214	3018	0.13
24	A	3115	2925	35.78
25	A	1537	1443	5.91
26	A	1477	1387	7.33
27	A	1425	1338	2.57
28	A	1183	1111	0.28
29	A	1011	950	10.83
30	A	570	535	5.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.672	0.665
C2	0.000	-0.672	0.665
C3	0.000	1.584	-0.524
C4	0.000	-1.584	-0.524
H5	0.000	1.166	1.631
H6	0.000	-1.166	1.631
H7	0.000	1.043	-1.465
H8	0.000	-1.043	-1.465
H9	-0.877	2.232	-0.509
H10	0.877	2.232	-0.509
H11	0.877	-2.232	-0.509
H12	-0.877	-2.232	-0.509

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.3444	1.4986	2.5507	1.0849	2.0768	2.1626	2.7350	2.1405	2.1405	3.2533	3.2533
C2	1.3444		2.5507	1.4986	2.0768	1.0849	2.7350	2.1626	3.2533	3.2533	2.1405	2.1405
C3	1.4986	2.5507		3.1688	2.1950	3.4943	1.0864	2.7907	1.0904	1.0904	3.9163	3.9163
C4	2.5507	1.4986	3.1688		3.4943	2.1950	2.7907	1.0864	3.9163	3.9163	1.0904	1.0904
H5	1.0849	2.0768	2.1950	3.4943		2.3327	3.0990	3.8037	2.5465	2.5465	4.1109	4.1109
H6	2.0768	1.0849	3.4943	2.1950	2.3327		3.8037	3.0990	4.1109	4.1109	2.5465	2.5465
H7	2.1626	2.7350	1.0864	2.7907	3.0990	3.8037		2.0853	1.7606	1.7606	3.5228	3.5228
H8	2.7350	2.1626	2.7907	1.0864	3.8037	3.0990	2.0853		3.5228	3.5228	1.7606	1.7606
H9	2.1405	3.2533	1.0904	3.9163	2.5465	4.1109	1.7606	3.5228		1.7538	4.7970	4.4649
H10	2.1405	3.2533	1.0904	3.9163	2.5465	4.1109	1.7606	3.5228	1.7538		4.4649	4.7970
H11	3.2533	2.1405	3.9163	1.0904	4.1109	2.5465	3.5228	1.7606	4.7970	4.4649		1.7538
H12	3.2533	2.1405	3.9163	1.0904	4.1109	2.5465	3.5228	1.7606	4.4649	4.7970	1.7538

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	127.496	C1	C2	H6	117.096
C1	C3	H7	112.590	C1	C3	H9	110.540
C1	C3	H10	110.540	C2	C1	C3	127.496
C2	C1	H5	117.096	C2	C4	H8	112.590
C2	C4	H11	110.540	C2	C4	H12	110.540
C3	C1	H5	115.408	C4	C2	H6	115.408
H7	C3	H9	107.953	H7	C3	H10	107.953
H8	C4	H11	107.953	H8	C4	H12	107.953
H9	C3	H10	107.057	H11	C4	H12	107.057

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

using model chemistry: MP2=FULL/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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All results from a given calculation for CH3CHCHCH3 (2-Butene, (Z)-)

using model chemistry: MP2=FULL/6-31+G**

States and conformations

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