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	hartrees
Energy at 0K	-156.708398
Energy at 298.15K	-156.716080
HF Energy	-156.120332
Nuclear repulsion energy	117.715784

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3257	3043	56.09
2	A	3243	3030	2.45
3	A	3128	2922	12.27
4	A	1766	1650	2.57
5	A	1560	1458	4.65
6	A	1473	1377	3.38
7	A	1326	1239	0.01
8	A	1056	987	0.54
9	A	898	839	0.42
10	A	302	282	0.00
11	A	3201	2991	0.00
12	A	1542	1440	0.00
13	A	1084	1012	0.00
14	A	1010	944	0.00
15	A	383	358	0.00
16	A	112	105	0.00
17	A	3201	2991	40.64
18	A	1547	1446	8.75
19	A	1102	1029	2.11
20	A	710	664	32.23
21	A	114	107	0.69
22	A	3242	3029	21.38
23	A	3222	3011	0.06
24	A	3124	2920	31.69
25	A	1551	1449	2.76
26	A	1486	1388	4.78
27	A	1432	1338	3.84
28	A	1188	1110	0.75
29	A	1017	951	9.31
30	A	572	534	5.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.670	0.665
C2	0.000	-0.670	0.665
C3	0.000	1.582	-0.523
C4	0.000	-1.582	-0.523
H5	0.000	1.166	1.629
H6	0.000	-1.166	1.629
H7	0.000	1.042	-1.464
H8	0.000	-1.042	-1.464
H9	-0.876	2.231	-0.509
H10	0.876	2.231	-0.509
H11	0.876	-2.231	-0.509
H12	-0.876	-2.231	-0.509

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.3408	1.4972	2.5466	1.0842	2.0744	2.1612	2.7322	2.1399	2.1399	3.2498	3.2498
C2	1.3408		2.5466	1.4972	2.0744	1.0842	2.7322	2.1612	3.2498	3.2498	2.1399	2.1399
C3	1.4972	2.5466		3.1650	2.1914	3.4907	1.0858	2.7883	1.0899	1.0899	3.9126	3.9126
C4	2.5466	1.4972	3.1650		3.4907	2.1914	2.7883	1.0858	3.9126	3.9126	1.0899	1.0899
H5	1.0842	2.0744	2.1914	3.4907		2.3326	3.0957	3.8006	2.5436	2.5436	4.1082	4.1082
H6	2.0744	1.0842	3.4907	2.1914	2.3326		3.8006	3.0957	4.1082	4.1082	2.5436	2.5436
H7	2.1612	2.7322	1.0858	2.7883	3.0957	3.8006		2.0839	1.7589	1.7589	3.5202	3.5202
H8	2.7322	2.1612	2.7883	1.0858	3.8006	3.0957	2.0839		3.5202	3.5202	1.7589	1.7589
H9	2.1399	3.2498	1.0899	3.9126	2.5436	4.1082	1.7589	3.5202		1.7521	4.7933	4.4616
H10	2.1399	3.2498	1.0899	3.9126	2.5436	4.1082	1.7589	3.5202	1.7521		4.4616	4.7933
H11	3.2498	2.1399	3.9126	1.0899	4.1082	2.5436	3.5202	1.7589	4.7933	4.4616		1.7521
H12	3.2498	2.1399	3.9126	1.0899	4.1082	2.5436	3.5202	1.7589	4.4616	4.7933	1.7521

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	127.530	C1	C2	H6	117.218
C1	C3	H7	112.614	C1	C3	H9	110.625
C1	C3	H10	110.625	C2	C1	C3	127.530
C2	C1	H5	117.218	C2	C4	H8	112.614
C2	C4	H11	110.625	C2	C4	H12	110.625
C3	C1	H5	115.251	C4	C2	H6	115.251
H7	C3	H9	107.888	H7	C3	H10	107.888
H8	C4	H11	107.888	H8	C4	H12	107.888
H9	C3	H10	106.981	H11	C4	H12	106.981

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

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

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/6-31G**

States and conformations

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