Geometry & MOs

Info

ID:	40360
PubChem CID:	8143991
Reduced:	ClSO2N4C20H23 (1)
Stoich.:	ABC2D4E20F23 (1)
Weight, g/mol:	415.108754
ΔH_f, kcal/mol:	-39.46
Dipole, Da:	4.76
IP(EA), eV:	-9.03(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(Z)-(8-phenylmethoxyquinolin-2-yl)methylideneamino]benzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CN(C)CC1=NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)N1

DOS

IR

Vibrations