Geometry & MOs

Info

ID:	439509
PubChem CID:	135229283
Reduced:	O2N3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	481.181313
ΔH_f, kcal/mol:	-19.97
Dipole, Da:	2.95
IP(EA), eV:	-8.2(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2-fluoroethoxy)phenyl]-4-[5-fluoro-1-(2-morpholin-4-ylethyl)indol-3-yl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

CCCCC(CC)COCC1=C(C(=CC(=C1)C)N2NC3C=CC=CC3=N2)O

DOS

IR

Vibrations