(1R,2R,5R,6R)-2,6-Dichloro-9-Thiabicyclo[3.3.1]Nonane

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Properties Simple | Detailed

Formula C8H12Cl2S
IUPAC Name (1r,2r,5r,6r)-2,6-dichloro-9-thiabicyclo[3.3.1]nonane
Molecular Mass 211.152 g·mol−1
Heat of Formation -185.9 ± 16.7 kJ·mol−1
Dipole Moment 0.91 ± 1.08 D
Volume 220.99 Å 3
Surface Area 193.42 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C2
Synonyms
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InChIKey QUZIEYDEASXPSN-WCTZXXKLSA-N
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Elements H S C Cl