Geometry & MOs

Info

ID:	260763
PubChem CID:	103202970
Reduced:	ON4C15H16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	332.06366
ΔH_f, kcal/mol:	30.75
Dipole, Da:	5.03
IP(EA), eV:	-8.44(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[5-bromo-2-(dimethylamino)anilino]methyl]-1-methylpyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

CN1C=C(C=C1C#N)CNC2=CC=CC=C2CC(=O)N

DOS

IR

Vibrations