Geometry & MOs

Info

ID:	56313
PubChem CID:	17425076
Reduced:	FSN3O3H18C23 (1)
Stoich.:	ABC3D3E18F23 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-72.35
Dipole, Da:	2.04
IP(EA), eV:	-8.63(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-methoxyphenyl)ethyl]-2-(5-methylfuran-2-yl)-1,2-dihydroquinazolin-4-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC4=C3N=CC=C4)F

DOS

IR

Vibrations