Geometry & MOs

Info

ID:	123063
PubChem CID:	50831756
Reduced:	FSN4O5C23H25 (1)
Stoich.:	ABC4D5E23F25 (1)
Weight, g/mol:	484.178041
ΔH_f, kcal/mol:	-213.08
Dipole, Da:	8.3
IP(EA), eV:	-9.37(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethylphenyl)-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)NCC3=CC=C(C=C3)F)C(=O)N(C1=O)CCC(=O)N4CCCC4

DOS

IR

Vibrations