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	hartrees
Energy at 0K	-614.715912
Energy at 298.15K	-614.723049
Nuclear repulsion energy	202.399478

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3199	3134	5.46
2	A'	3117	3053	5.01
3	A'	3090	3027	20.14
4	A'	2986	2926	16.01
5	A'	2956	2896	19.39
6	A'	1705	1670	17.94
7	A'	1487	1456	13.40
8	A'	1455	1425	7.94
9	A'	1396	1367	19.19
10	A'	1352	1325	8.48
11	A'	1289	1263	3.13
12	A'	1226	1202	2.80
13	A'	1124	1101	3.32
14	A'	1044	1023	5.17
15	A'	919	900	8.78
16	A'	803	787	72.34
17	A'	512	502	2.08
18	A'	322	316	1.70
19	A'	187	183	0.44
20	A"	3070	3008	20.91
21	A"	2988	2927	9.55
22	A"	1476	1446	14.08
23	A"	1260	1234	0.02
24	A"	1090	1068	0.88
25	A"	943	924	57.30
26	A"	833	816	17.12
27	A"	728	713	1.26
28	A"	293	287	1.44
29	A"	197	193	0.72
30	A"	161	157	0.36

Atom	x (Å)	y (Å)	z (Å)
C1	1.957	-1.600	0.000
H2	2.571	-2.516	0.000
H3	2.233	-1.010	0.892
H4	2.233	-1.010	-0.892
C5	0.479	-1.932	0.000
H6	0.235	-2.566	-0.879
H7	0.235	-2.566	0.879
C8	0.000	0.507	0.000
Cl9	-1.121	1.909	0.000
H10	1.046	0.820	0.000
C11	-0.432	-0.751	0.000
H12	-1.513	-0.948	0.000

	C1	H2	H3	H4	C5	H6	H7	C8	Cl9	H10	C11	H12
C1		1.1025	1.1054	1.1054	1.5148	2.1611	2.1611	2.8756	4.6679	2.5860	2.5351	3.5300
H2	1.1025		1.7828	1.7828	2.1723	2.4970	2.4970	3.9683	5.7630	3.6678	3.4832	4.3743
H3	1.1054	1.7828		1.7849	2.1741	3.0910	2.5332	2.8435	4.5354	2.3569	2.8228	3.8514
H4	1.1054	1.7828	1.7849		2.1741	2.5332	3.0910	2.8435	4.5354	2.3569	2.8228	3.8514
C5	1.5148	2.1723	2.1741	2.1741		1.1105	1.1105	2.4858	4.1613	2.8100	1.4914	2.2212
H6	2.1611	2.4970	3.0910	2.5332	1.1105		1.7576	3.2045	4.7575	3.5906	2.1234	2.5379
H7	2.1611	2.4970	2.5332	3.0910	1.1105	1.7576		3.2045	4.7575	3.5906	2.1234	2.5379
C8	2.8756	3.9683	2.8435	2.8435	2.4858	3.2045	3.2045		1.7953	1.0914	1.3304	2.0990
Cl9	4.6679	5.7630	4.5354	4.5354	4.1613	4.7575	4.7575	1.7953		2.4251	2.7482	2.8841
H10	2.5860	3.6678	2.3569	2.3569	2.8100	3.5906	3.5906	1.0914	2.4251		2.1568	3.1098
C11	2.5351	3.4832	2.8228	2.8228	1.4914	2.1234	2.1234	1.3304	2.7482	2.1568		1.0984
H12	3.5300	4.3743	3.8514	3.8514	2.2212	2.5379	2.5379	2.0990	2.8841	3.1098	1.0984

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C5	H6	109.850	C1	C5	H7	109.850
C1	C5	C11	114.975	H2	C1	H3	107.696
H2	C1	H4	107.696	H2	C1	C5	111.214
H3	C1	H4	107.685	H3	C1	C5	111.187
H4	C1	C5	111.187	C5	C11	C8	123.411
C5	C11	H12	117.303	H6	C5	H7	104.631
H6	C5	C11	108.508	H7	C5	C11	108.508
C8	C11	H12	119.286	Cl9	C8	H10	111.987
Cl9	C8	C11	122.400	H10	C8	C11	125.613

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

using model chemistry: LSDA/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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Number	Element	Mulliken
1	C	-0.519
2	H	0.174
3	H	0.177
4	H	0.177
5	C	-0.365
6	H	0.186
7	H	0.186
8	C	-0.411
9	Cl	0.047
10	H	0.201
11	C	-0.030
12	H	0.175

	x	y	z	Total
	1.271	-2.285	0.000	2.615
CHELPG
AIM
ESP

	x	y	z
x	7.540	-1.596	0.000
y	-1.596	10.850	0.000
z	0.000	0.000	4.646

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: LSDA/6-31G

States and conformations

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