Geometry & MOs

Info

ID:	335052
PubChem CID:	127253858
Reduced:	O3N4C30H30 (1)
Stoich.:	A3B4C30D30 (1)
Weight, g/mol:	383.115758
ΔH_f, kcal/mol:	-45.23
Dipole, Da:	5.55
IP(EA), eV:	-8.9(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

C1CCN2CCC[C@H]([C@H]2C1)CNC(=O)COC3=CC4=C(C=C3)C5=C6N4C(=O)C7=CC=CC=C7C6=NC=C5

DOS

IR

Vibrations