Geometry & MOs

Info

ID:	391342
PubChem CID:	135004410
Reduced:	N2O2H14C15 (1)
Stoich.:	A2B2C14D15 (1)
Weight, g/mol:	425.148321
ΔH_f, kcal/mol:	0.95
Dipole, Da:	6.45
IP(EA), eV:	-8.62(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-[bis(ethylsulfanyl)methylidene]-N-(2-methylphenyl)-5-(4-methylphenyl)-3-oxopent-4-enamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC3=NC=CN3C(=C2)OC

DOS

IR

Vibrations