Geometry & MOs

Info

ID:	57654
PubChem CID:	22429989
Reduced:	N4O5H20C23 (1)
Stoich.:	A4B5C20D23 (1)
Weight, g/mol:	500.065425
ΔH_f, kcal/mol:	-126.39
Dipole, Da:	3.45
IP(EA), eV:	-9.07(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dichlorophenyl)-2-[3-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2,4-dioxoquinazolin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)CC(=O)NCC4=CC=CO4

DOS

IR

Vibrations