Geometry & MOs

Info

ID:	167721
PubChem CID:	74863104
Reduced:	OS2N6H20C24 (1)
Stoich.:	AB2C6D20E24 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	146.07
Dipole, Da:	10.93
IP(EA), eV:	-8.81(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[1-(3,4-dipropoxyphenyl)ethylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

DOS

IR

Vibrations