Geometry & MOs

Info

ID:	247487
PubChem CID:	103071789
Reduced:	NC4H5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	294.00039
ΔH_f, kcal/mol:	54.71
Dipole, Da:	5.77
IP(EA), eV:	-8.71(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)prop-2-enyl]-6-bromoindole-2,3-dione

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2N1CC(=C)CN

DOS

IR

Vibrations