Geometry & MOs

Info

ID:	161780
PubChem CID:	57392643
Reduced:	Cl3N4O6C34H37 (1)
Stoich.:	A3B4C6D34E37 (1)
Weight, g/mol:	383.152144
ΔH_f, kcal/mol:	-187.03
Dipole, Da:	8.1
IP(EA), eV:	-8.6(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N-[4-(4-methoxyphenyl)phenyl]naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)N3[C@H](CNCC3=O)C(=O)N(CC4=C(C=CC(=C4)CCOC(=O)NC)Cl)C5CC5)Cl

DOS

IR

Vibrations