Geometry & MOs

Info

ID:	398798
PubChem CID:	135035461
Reduced:	OSN2C12H12 (1)
Stoich.:	ABC2D12E12 (1)
Weight, g/mol:	294.082684
ΔH_f, kcal/mol:	16.03
Dipole, Da:	5.36
IP(EA), eV:	-8.97(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methyl-2-oxo-3-phenylindol-3-yl)methyl thiocyanate

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2N(C1=O)C)CSC#N

DOS

IR

Vibrations