Geometry & MOs

Info

ID:	397386
PubChem CID:	135030139
Reduced:	FOH15C21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	324.056863
ΔH_f, kcal/mol:	-20.19
Dipole, Da:	1.4
IP(EA), eV:	-8.85(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-hydroxy-2-oxo-1H-indol-3-yl)-2-oxo-2-phenylethyl] thiocyanate

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=C1)C3=C(C=CC(=C3)C=O)C4=C2C=C(C=C4)F)C

DOS

IR

Vibrations