Geometry & MOs

Info

ID:	30441
PubChem CID:	841341
Reduced:	NOSC14H15 (1)
Stoich.:	ABCD14E15 (1)
Weight, g/mol:	332.09277
ΔH_f, kcal/mol:	-9.69
Dipole, Da:	3.45
IP(EA), eV:	-9.1(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[[4-methoxy-3-(methoxymethyl)phenyl]methylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)C2=C(C=CS2)C

DOS

IR

Vibrations