Geometry & MOs

Info

ID:	127050
PubChem CID:	50988449
Reduced:	OCl2N2H4C6 (1)
Stoich.:	AB2C2D4E6 (1)
Weight, g/mol:	424.014825
ΔH_f, kcal/mol:	-1.61
Dipole, Da:	2.69
IP(EA), eV:	-10.4(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2Z)-2-[5-amino-4-(4-chlorophenyl)-3-oxofuran-2-ylidene]-2-(4-chlorophenyl)ethanimidate;hydrochloride

Drug info:

PubChemData

Smile

C1=CN=CC2=C1N=C(O2)Cl.Cl

DOS

IR

Vibrations