Geometry & MOs

Info

ID:	53029
PubChem CID:	14709422
Reduced:	SO2N4H14C19 (1)
Stoich.:	AB2C4D14E19 (1)
Weight, g/mol:	376.099397
ΔH_f, kcal/mol:	86.36
Dipole, Da:	8.53
IP(EA), eV:	-8.89(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-2-(4-methoxyphenyl)-5-[(4-methylphenyl)hydrazinylidene]-4-oxothiolane-3,3-dicarbonitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2C(C(=O)/C(=N/NC3=CC=CC=C3)/S2)(C#N)C#N

DOS

IR

Vibrations