Geometry & MOs

Info

ID:	124513
PubChem CID:	50885807
Reduced:	ClSN2O2H21C24 (1)
Stoich.:	ABC2D2E21F24 (1)
Weight, g/mol:	346.10659
ΔH_f, kcal/mol:	31.08
Dipole, Da:	7.12
IP(EA), eV:	-8.65(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-methoxyphenyl)hydrazinylidene]-2,6-dioxo-4-phenylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OCC2=CC=CC=C2Cl)C=NC3=C(C4=C(S3)CCCC4)C#N

DOS

IR

Vibrations