Geometry & MOs

Info

ID:	225445
PubChem CID:	85786921
Reduced:	NSO2F3C10H10 (1)
Stoich.:	ABC2D3E10F10 (1)
Weight, g/mol:	338.259623
ΔH_f, kcal/mol:	-202.84
Dipole, Da:	8.6
IP(EA), eV:	-9.03(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

trimethyl-[3-[4-[2-(1-methylindol-3-yl)ethyl]-2H-pyridin-1-yl]propyl]azanium

Drug info:

PubChemData

Smile

CS(=O)C1=CC=CC=C1CNC(=O)C(F)(F)F

DOS

IR

Vibrations