Geometry & MOs

Info

ID:	193790
PubChem CID:	78437234
Reduced:	NO2F5H8C10 (1)
Stoich.:	AB2C5D8E10 (1)
Weight, g/mol:	364.140496
ΔH_f, kcal/mol:	-293.45
Dipole, Da:	6.81
IP(EA), eV:	-10.63(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[4-(2-methoxyphenyl)piperidin-1-ium-1-yl]-3-thiophen-2-ylsulfanylpropan-2-ol

Drug info:

PubChemData

Smile

C(C1=C(C(=C(C(=C1F)F)F)F)F)C(CC(=O)[O-])[NH3+]

DOS

IR

Vibrations