Geometry & MOs

Info

ID:	334020
PubChem CID:	127252572
Reduced:	ClO6H17C26 (1)
Stoich.:	AB6C17D26 (1)
Weight, g/mol:	425.162708
ΔH_f, kcal/mol:	-157.98
Dipole, Da:	7.2
IP(EA), eV:	-8.84(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-(3-phenylpropyl)indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC(=O)CC1=C(OC2=C1C3=C(C(=C2)O)C(=O)C=C(O3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations