Geometry & MOs

Info

ID:	247542
PubChem CID:	103072161
Reduced:	BrN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	350.06299
ΔH_f, kcal/mol:	-27.42
Dipole, Da:	6.43
IP(EA), eV:	-9.04(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-7-methyl-1-[2-(propylaminomethyl)prop-2-enyl]indole-2,3-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations