Geometry & MOs

Info

ID:	322846
PubChem CID:	126671450
Reduced:	IN2O2H11C19 (1)
Stoich.:	AB2C2D11E19 (1)
Weight, g/mol:	368.116092
ΔH_f, kcal/mol:	72.24
Dipole, Da:	1.57
IP(EA), eV:	-8.47(-2.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[5-(2,3-dihydro-1-benzofuran-2-yl)-1,3-benzodioxol-2-yl]quinazoline

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(O2)C3=CC4=C(C=C3)C=C(N4I)C5=NC=CO5

DOS

IR

Vibrations