N-(4-T-Butylbenzyl)-N'-(4-(Methylsulfonylamino)Benzyl)Thiourea

Molecule SVG Image

Properties Simple | Detailed

Formula C20H27N3O2S2
IUPAC Name 1-[(4-tert-butylphenyl)methyl]-3-[[4-(methanesulfonamido)phenyl]methyl]thiourea
Molecular Mass 405.577 g·mol−1
Heat of Formation -194.9 ± 16.7 kJ·mol−1
Dipole Moment 8.35 ± 1.08 D
Volume 491.51 Å 3
Surface Area 437.68 Å 2
HOMO Energy -8.14 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-tert-butylbenzyl)-3-(4-methanesulfonamidobenzyl)thiourea
  • 1-[(4-tert-butylphenyl)methyl]-3-[[4-(methylsulfonylamino)phenyl]methyl]thiourea
InChIKey LOMAEJPLJSUBML-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N