Geometry & MOs

Info

ID:	41496
PubChem CID:	8145971
Reduced:	ClSO2N4C17H21 (1)
Stoich.:	ABC2D4E17F21 (1)
Weight, g/mol:	335.107005
ΔH_f, kcal/mol:	-27.68
Dipole, Da:	2.95
IP(EA), eV:	-8.55(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-naphthalen-2-yloxamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCCN(C1)CN2C(=S)N(C=N2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations