Geometry & MOs

Info

ID:	121306
PubChem CID:	50762404
Reduced:	SO2N4C22H22 (1)
Stoich.:	AB2C4D22E22 (1)
Weight, g/mol:	499.129884
ΔH_f, kcal/mol:	14.52
Dipole, Da:	4.85
IP(EA), eV:	-9.28(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[1-[(2-chlorophenyl)methyl]-2,4-dioxoquinazolin-3-yl]phenyl]-N-(furan-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NCCN2C3=C(C=CC=N3)N=C2C4=CC=CC=C4)C

DOS

IR

Vibrations