Geometry & MOs

Info

ID:	50916
PubChem CID:	12013509
Reduced:	OSN5H17C20 (1)
Stoich.:	ABC5D17E20 (1)
Weight, g/mol:	393.089561
ΔH_f, kcal/mol:	105.57
Dipole, Da:	7.41
IP(EA), eV:	-8.48(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (5Z)-5-[(2-oxoindol-3-yl)hydrazinylidene]-4-phenyl-1,3,4-thiadiazole-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=NC3=NNC(=C3)C4=CC=CC=C4)SC(=N2)C(=O)C

DOS

IR

Vibrations