Geometry & MOs

Info

ID:	123061
PubChem CID:	50831754
Reduced:	SN4O5C24H28 (1)
Stoich.:	AB4C5D24E28 (1)
Weight, g/mol:	474.137319
ΔH_f, kcal/mol:	-177.44
Dipole, Da:	8.11
IP(EA), eV:	-8.57(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-1-methyl-2,4-dioxo-3-(3-oxo-3-pyrrolidin-1-ylpropyl)quinazoline-6-sulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CCC(=O)N4CCCC4)C

DOS

IR

Vibrations