Geometry & MOs

Info

ID:	247551
PubChem CID:	103072200
Reduced:	ClN2O2C11H11 (1)
Stoich.:	AB2C2D11E11 (1)
Weight, g/mol:	292.097855
ΔH_f, kcal/mol:	-44.9
Dipole, Da:	5.09
IP(EA), eV:	-9.43(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-1-[2-(propylaminomethyl)prop-2-enyl]indole-2,3-dione

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)C(=O)C(=O)N2CCCN

DOS

IR

Vibrations