Geometry & MOs

Info

ID:	260756
PubChem CID:	103202919
Reduced:	ON4C16H18 (1)
Stoich.:	AB4C16D18 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	29.54
Dipole, Da:	3.03
IP(EA), eV:	-8.4(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-ethoxy-4-methoxyanilino)methyl]-1-methylpyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC)NCC2=CN(C(=C2)C#N)C

DOS

IR

Vibrations