Geometry & MOs

Info

ID:	334614
PubChem CID:	127253289
Reduced:	N4O6H24C27 (1)
Stoich.:	A4B6C24D27 (1)
Weight, g/mol:	384.147393
ΔH_f, kcal/mol:	-133.61
Dipole, Da:	7.93
IP(EA), eV:	-9.29(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(dimethylamino)-2-(furan-2-yl)ethyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC1=C(C(=C2C(=C1O)[C@@]3(C(=CC(=O)/C(=C(/C)\NC4=CC=C(C=C4)CN5C=NC=N5)/C3=O)O2)C)C(=O)C)O

DOS

IR

Vibrations