1-(2-Chloroethyl)-1-Nitroso-3-(4-Thiomorpholinyl)Urea

Molecule SVG Image

Properties Simple | Detailed

Formula C7H13ClN4O2S
IUPAC Name 1-(2-chloroethyl)-1-nitroso-3-thiomorpholino-urea
Molecular Mass 252.722 g·mol−1
Heat of Formation -82.5 ± 16.7 kJ·mol−1
Dipole Moment 3.19 ± 1.08 D
Volume 281.15 Å 3
Surface Area 259.38 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-chloroethyl)-1-nitroso-3-(4-thiomorpholino)urea
  • 1-(2-chloroethyl)-1-nitroso-3-thiomorpholin-4-yl-urea
  • 1-(2-chloroethyl)-1-nitroso-3-thiomorpholin-4-ylurea
  • 1-(2-chloroethyl)-1-nitroso-3-thiomorpholinourea
  • urea, n-(2-chloroethyl)-n-nitroso-n'-4-thiomorpholinyl-
CAS Number(s)
  • 114562-61-7
InChIKey CTSVSIVXRZLSSJ-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S