3-Phenyl-1,3,4-Thiadiazolidine-2,5-Dithione

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Properties Simple | Detailed

Formula C8H6N2S3
IUPAC Name 3-phenyl-1,3,4-thiadiazolidine-2,5-dithione
Molecular Mass 226.342 g·mol−1
Heat of Formation 445.8 ± 16.7 kJ·mol−1
Dipole Moment 4.85 ± 1.08 D
Volume 245.32 Å 3
Surface Area 230.23 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -1.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,4-thiadiazolidine-2,5-dithione, 3-phenyl- (9ci)
  • 2h-1,3,4-thiadiazole-2-thione, 5-mercapto-3-phenyl-
  • 3-phenylbismuthol
  • 5-mercapto-3-phenyl-2h-1,3,4-thiadiazole-2-thione
  • bismuthiol ii
  • delta2-1,3,4-thiadiazolidine-5-thione, 2-mercapto-4-phenyl- (6ci,8ci)
  • enamine_005270
  • t0514-8916
CAS Number(s)
  • 17654-88-5
InChIKey JRFUIXXCQSIOEB-UHFFFAOYSA-N
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