Geometry & MOs

Info

ID:	247685
PubChem CID:	103072674
Reduced:	NOC5H8 (2)
Stoich.:	ABC5D8 (2)
Weight, g/mol:	310.088434
ΔH_f, kcal/mol:	-85.11
Dipole, Da:	2.37
IP(EA), eV:	-9.61(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-6-fluoro-1-[2-(propylaminomethyl)prop-2-enyl]indole-2,3-dione

Drug info:

PubChemData

Smile

CC1C(C(=O)N(C1=O)CC(=C)CN)C

DOS

IR

Vibrations