Geometry & MOs

Info

ID:	53131
PubChem CID:	14709633
Reduced:	NSH15C16 (1)
Stoich.:	ABC15D16 (1)
Weight, g/mol:	225.061221
ΔH_f, kcal/mol:	64.04
Dipole, Da:	4.07
IP(EA), eV:	-8.43(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-3H-indole-2-thione

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2N(C1=S)C)C3=CC=CC=C3

DOS

IR

Vibrations