Geometry & MOs

Info

ID:	200075
PubChem CID:	79343377
Reduced:	ClON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	306.124739
ΔH_f, kcal/mol:	-0.51
Dipole, Da:	1.75
IP(EA), eV:	-8.54(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[5-chloro-3-(ethylamino)-2-oxo-1,3-dihydroindol-6-yl]-ethylamino]propanenitrile

Drug info:

PubChemData

Smile

CCN(CC(C)C#N)C1=C(C=C2C(C(=O)NC2=C1)NC)Cl

DOS

IR

Vibrations