Geometry & MOs

Info

ID:	123062
PubChem CID:	50831755
Reduced:	FSN4O5C22H23 (1)
Stoich.:	ABC4D5E22F23 (1)
Weight, g/mol:	488.152969
ΔH_f, kcal/mol:	-210.87
Dipole, Da:	4.21
IP(EA), eV:	-9.17(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3F)C(=O)N(C1=O)CCC(=O)N4CCCC4

DOS

IR

Vibrations