4-Sulfamoyl-N-{4-[(Sulfanylmethyl)Amino]Butyl}Benzamide

Molecule SVG Image

Properties Simple | Detailed

Formula C12H19N3O3S2
IUPAC Name 4-sulfamoyl-n-[4-(sulfanylmethylamino)butyl]benzamide
Molecular Mass 317.428 g·mol−1
Heat of Formation -431.5 ± 16.7 kJ·mol−1
Dipole Moment 2.69 ± 1.08 D
Volume 369.15 Å 3
Surface Area 347.02 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry C1
Synonyms
  • 4-sulfonamide-[4-(thiomethylaminobutane)]benzamide
  • n-[4-(mercaptomethylamino)butyl]-4-sulfamoyl-benzamide
  • n-[4-(mercaptomethylamino)butyl]-4-sulfamoylbenzamide
  • stb
InChIKey XLYYIFIRODREFK-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N