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	hartrees
Energy at 0K	-614.792889
Energy at 298.15K	-614.800016
HF Energy	-614.792889
Nuclear repulsion energy	204.625608

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3148	3101	6.34
2	A'	3100	3054	5.82
3	A'	3078	3032	16.58
4	A'	2981	2937	17.89
5	A'	2954	2910	18.69
6	A'	1682	1657	16.40
7	A'	1442	1420	10.63
8	A'	1401	1380	8.89
9	A'	1357	1336	17.69
10	A'	1321	1301	7.03
11	A'	1260	1241	0.71
12	A'	1205	1188	3.44
13	A'	1102	1085	5.09
14	A'	1010	995	13.45
15	A'	907	894	10.47
16	A'	843	830	64.63
17	A'	517	509	0.92
18	A'	327	322	0.74
19	A'	188	185	0.28
20	A"	3059	3014	16.96
21	A"	2983	2939	6.14
22	A"	1431	1410	13.86
23	A"	1228	1210	0.10
24	A"	1051	1035	1.90
25	A"	918	905	49.06
26	A"	802	790	9.59
27	A"	701	691	0.87
28	A"	298	294	1.41
29	A"	199	196	1.36
30	A"	167	165	0.10

Atom	x (Å)	y (Å)	z (Å)
C1	1.915	-1.666	0.000
H2	2.450	-2.624	0.000
H3	2.212	-1.102	0.893
H4	2.212	-1.102	-0.893
C5	0.404	-1.904	0.000
H6	0.154	-2.502	-0.888
H7	0.154	-2.502	0.888
C8	0.000	0.565	0.000
Cl9	-1.054	1.888	0.000
H10	1.032	0.782	0.000
C11	-0.451	-0.698	0.000
H12	-1.502	-0.841	0.000

	C1	H2	H3	H4	C5	H6	H7	C8	Cl9	H10	C11	H12
C1		1.0974	1.0972	1.0972	1.5295	2.1425	2.1425	2.9403	4.6315	2.6017	2.5565	3.5158
H2	1.0974		1.7809	1.7809	2.1684	2.4645	2.4645	4.0216	5.7134	3.6889	3.4820	4.3358
H3	1.0972	1.7809		1.7859	2.1702	3.0612	2.4895	2.9106	4.5179	2.3952	2.8381	3.8297
H4	1.0972	1.7809	1.7859		2.1702	2.4895	3.0612	2.9106	4.5179	2.3952	2.8381	3.8297
C5	1.5295	2.1684	2.1702	2.1702		1.0998	1.0998	2.5020	4.0632	2.7578	1.4785	2.1831
H6	2.1425	2.4645	3.0612	2.4895	1.0998		1.7766	3.1969	4.6395	3.5131	2.0999	2.5084
H7	2.1425	2.4645	2.4895	3.0612	1.0998	1.7766		3.1969	4.6395	3.5131	2.0999	2.5084
C8	2.9403	4.0216	2.9106	2.9106	2.5020	3.1969	3.1969		1.6919	1.0547	1.3412	2.0579
Cl9	4.6315	5.7134	4.5179	4.5179	4.0632	4.6395	4.6395	1.6919		2.3621	2.6558	2.7660
H10	2.6017	3.6889	2.3952	2.3952	2.7578	3.5131	3.5131	1.0547	2.3621		2.0950	3.0096
C11	2.5565	3.4820	2.8381	2.8381	1.4785	2.0999	2.0999	1.3412	2.6558	2.0950		1.0612
H12	3.5158	4.3358	3.8297	3.8297	2.1831	2.5084	2.5084	2.0579	2.7660	3.0096	1.0612

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C5	H6	108.031	C1	C5	H7	108.031
C1	C5	C11	116.391	H2	C1	H3	108.484
H2	C1	H4	108.484	H2	C1	C5	110.184
H3	C1	H4	108.953	H3	C1	C5	110.342
H4	C1	C5	110.342	C5	C11	C8	125.003
C5	C11	H12	117.599	H6	C5	H7	107.750
H6	C5	C11	108.173	H7	C5	C11	108.173
C8	C11	H12	117.398	Cl9	C8	H10	116.714
Cl9	C8	C11	121.802	H10	C8	C11	121.484

All results from a given calculation for CHClCHCH₂CH₃ ((Z)-1-Chloro-1-butene)

using model chemistry: SVWN/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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Number	Element	Mulliken
1	C	-0.722
2	H	0.190
3	H	0.196
4	H	0.196
5	C	-0.406
6	H	0.197
7	H	0.197
8	C	-0.375
9	Cl	0.126
10	H	0.193
11	C	0.032
12	H	0.175

	x	y	z	Total
	0.965	-1.959	0.000	2.184
CHELPG
AIM
ESP

	x	y	z
x	8.792	-1.294	0.000
y	-1.294	12.309	0.000
z	0.000	0.000	6.643

<r²>	217.578
(<r²>)^1/2	14.751

All results from a given calculation for CHClCHCH2CH3 ((Z)-1-Chloro-1-butene)

using model chemistry: SVWN/6-31+G**

States and conformations

All results from a given calculation for CHClCHCH₂CH₃ ((Z)-1-Chloro-1-butene)