Geometry & MOs

Info

ID:	247545
PubChem CID:	103072171
Reduced:	ClN2O2H11C12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	278.082205
ΔH_f, kcal/mol:	-20.96
Dipole, Da:	4.87
IP(EA), eV:	-9.33(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1-[2-(ethylaminomethyl)prop-2-enyl]indole-2,3-dione

Drug info:

PubChemData

Smile

C=C(CN)CN1C2=C(C=CC=C2Cl)C(=O)C1=O

DOS

IR

Vibrations