Geometry & MOs

Info

ID:	335010
PubChem CID:	127253816
Reduced:	N2F3O5H17C20 (1)
Stoich.:	A2B3C5D17E20 (1)
Weight, g/mol:	480.168522
ΔH_f, kcal/mol:	-273.5
Dipole, Da:	4.66
IP(EA), eV:	-8.98(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CN1CCC2=C(C3=C(C(=C2C1=O)OC)OCO3)CNC(=O)C4=CC(=C(C(=C4)F)F)F

DOS

IR

Vibrations