Geometry & MOs

Info

ID:	85692
PubChem CID:	49878267
Reduced:	ClN4O4C16H21 (1)
Stoich.:	AB4C4D16E21 (1)
Weight, g/mol:	393.184112
ΔH_f, kcal/mol:	-141.91
Dipole, Da:	5.81
IP(EA), eV:	-8.63(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(naphthalen-2-ylamino)-N-[(E)-1-(4-phenylphenyl)ethylideneamino]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C/C(=N/NC(=O)C(=O)NCCOC)/C)Cl

DOS

IR

Vibrations