Geometry & MOs

Info

ID:	339536
PubChem CID:	127261526
Reduced:	Br2N3O3C19H19 (1)
Stoich.:	A2B3C3D19E19 (1)
Weight, g/mol:	331.168462
ΔH_f, kcal/mol:	-73.27
Dipole, Da:	3.04
IP(EA), eV:	-9.3(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(E)-naphthalen-2-ylmethylideneamino]-N-(2-phenylethyl)acetamide

Drug info:

PubChemData

Smile

CC1N(C(=O)C2=C(N1C3=CC=CC=C3)C(=CC(=C2)Br)Br)CCOC(=O)CN

DOS

IR

Vibrations