Geometry & MOs

Info

ID:	143722
PubChem CID:	53253216
Reduced:	O8C27H32 (1)
Stoich.:	A8B27C32 (1)
Weight, g/mol:	346.142976
ΔH_f, kcal/mol:	-249.14
Dipole, Da:	5.78
IP(EA), eV:	-10.08(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-[1-(3-pyridin-2-ylpropyl)indol-3-yl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

CCCCCCCC(=O)C1=CC(=C(C=C1)OC(=O)OC(C)(C)C)C(=O)OOC(=O)C2=CC=CC=C2

DOS

IR

Vibrations