Geometry & MOs

Info

ID:	51275
PubChem CID:	12013920
Reduced:	N3O4H23C29 (1)
Stoich.:	A3B4C23D29 (1)
Weight, g/mol:	513.150012
ΔH_f, kcal/mol:	-28.5
Dipole, Da:	5.47
IP(EA), eV:	-8.41(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dimethoxyphenyl)methyl]-3,4-bis(5-fluoro-1H-indol-3-yl)pyrrole-2,5-dione

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)CN2C(=O)C(=C(C2=O)C3=CNC4=CC=CC=C43)C5=CNC6=CC=CC=C65)OC

DOS

IR

Vibrations