Geometry & MOs

Info

ID:	354907
PubChem CID:	127287667
Reduced:	SO3N4C13H16 (1)
Stoich.:	AB3C4D13E16 (1)
Weight, g/mol:	371.097349
ΔH_f, kcal/mol:	-59.52
Dipole, Da:	8.54
IP(EA), eV:	-9.65(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopropyl-4-oxopyrimidin-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)-N-ethylacetamide

Drug info:

PubChemData

Smile

C1CC1NC(=O)NC(=O)CSC2=NC(=O)C=CN2C3CC3

DOS

IR

Vibrations