Geometry & MOs

Info

ID:	247543
PubChem CID:	103072163
Reduced:	BrN2O2C16H19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	352.02227
ΔH_f, kcal/mol:	-32.24
Dipole, Da:	6.31
IP(EA), eV:	-8.96(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-[2-[(cyclopropylamino)methyl]prop-2-enyl]-6-fluoroindole-2,3-dione

Drug info:

PubChemData

Smile

CCCNCC(=C)CN1C2=C(C=C(C=C2C)Br)C(=O)C1=O

DOS

IR

Vibrations