Geometry & MOs

Info

ID:	57653
PubChem CID:	22429972
Reduced:	N3O3H29C32 (1)
Stoich.:	A3B3C29D32 (1)
Weight, g/mol:	432.14337
ΔH_f, kcal/mol:	-48.14
Dipole, Da:	8.37
IP(EA), eV:	-9.22(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)C

DOS

IR

Vibrations