Geometry & MOs

Info

ID:	327621
PubChem CID:	126690540
Reduced:	N5O5H35C39 (1)
Stoich.:	A5B5C35D39 (1)
Weight, g/mol:	399.194677
ΔH_f, kcal/mol:	-80.44
Dipole, Da:	8.74
IP(EA), eV:	-8.83(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[amino-[4-[[methyl(2-oxoethyl)amino]methyl]phenyl]methylidene]-4-(4-methylphenyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N=C(C3=CC=C(C=C3)CN(CC(=O)O)C(=O)C4=CC=C(C=C4)NC(=O)CC5=CC=C(C=C5)N)N

DOS

IR

Vibrations