Geometry & MOs

Info

ID:	57648
PubChem CID:	22429611
Reduced:	N2O3H20C22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	423.098584
ΔH_f, kcal/mol:	-59.53
Dipole, Da:	4.51
IP(EA), eV:	-9.2(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CO4

DOS

IR

Vibrations