Geometry & MOs

Info

ID:	200074
PubChem CID:	79343376
Reduced:	ClO2N3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	306.124739
ΔH_f, kcal/mol:	-76.36
Dipole, Da:	6.0
IP(EA), eV:	-8.53(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1CCCN(C1)C2=C(C=C3C(C(=O)NC3=C2)N)Cl

DOS

IR

Vibrations