Geometry & MOs

Info

ID:	33341
PubChem CID:	7886016
Reduced:	SN2O2H16C17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	390.082033
ΔH_f, kcal/mol:	-15.96
Dipole, Da:	1.35
IP(EA), eV:	-8.63(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanyl-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC3=C2C(=O)N(C=N3)CCOC4=CC=CC=C4

DOS

IR

Vibrations