Geometry & MOs

Info

ID:	337418
PubChem CID:	127257103
Reduced:	OSN4H8C13 (1)
Stoich.:	ABC4D8E13 (1)
Weight, g/mol:	344.108026
ΔH_f, kcal/mol:	114.72
Dipole, Da:	9.68
IP(EA), eV:	-8.49(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-[(4-chlorophenyl)methylidene]-N-(4-methylphenyl)indol-2-amine

Drug info:

PubChemData

Smile

C1=COC(=C1)C2=CS/C(=C\3/N=C4C=CN=CC4=N3)/N2

DOS

IR

Vibrations