1-Adamantan-1-Yl-3-(2-{[(6-Chloro-2,3-Dihydroimidazo[2,1-B][1,3]Thiazol-5-Yl)Methyl]Sulfanyl}Ethyl)Thiourea

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Formula C19H27ClN4S3
IUPAC Name 1-(1-adamantyl)-3-[2-[(6-chloro-2,3-dihydroimidazo[2,1-b]thiazol-4-ium-5-ylium-5-yl)methylsulfanyl]ethyl]thiourea
Molecular Mass 443.092 g·mol−1
Heat of Formation 110.7 ± 16.7 kJ·mol−1
Dipole Moment 10.30 ± 1.08 D
Volume 507.29 Å 3
Surface Area 391.31 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
InChIKey DXCMEIDZDUPBLP-KRFSREQESA-N
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Elements H S N C Cl