Geometry & MOs

Info

ID:	56284
PubChem CID:	17424982
Reduced:	OSN6H14C18 (1)
Stoich.:	ABC6D14E18 (1)
Weight, g/mol:	225.090212
ΔH_f, kcal/mol:	128.12
Dipole, Da:	8.89
IP(EA), eV:	-9.18(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-[(1-methylpyrazol-4-yl)methylidene]-1H-indol-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)CN4C=NN=N4

DOS

IR

Vibrations