Geometry & MOs

Info

ID:	125921
PubChem CID:	50944079
Reduced:	SO2N4H12C15 (1)
Stoich.:	AB2C4D12E15 (1)
Weight, g/mol:	479.184506
ΔH_f, kcal/mol:	5.36
Dipole, Da:	8.13
IP(EA), eV:	-8.14(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-4-[[1-[(4-methylphenyl)methyl]-2,4-dioxoquinazolin-3-yl]methyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N)C2=CC(=CNC2=O)/C=C/3\C(=O)N=C(S3)N

DOS

IR

Vibrations