Geometry & MOs

Info

ID:	269979
PubChem CID:	103621623
Reduced:	SO2N3C6H9 (1)
Stoich.:	AB2C3D6E9 (1)
Weight, g/mol:	235.137242
ΔH_f, kcal/mol:	-26.44
Dipole, Da:	7.39
IP(EA), eV:	-9.69(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-azabicyclo[2.2.1]heptan-2-yl)-1-(2-fluorophenyl)ethanol

Drug info:

PubChemData

Smile

CC(C(=O)NC1=NN=CS1)OC

DOS

IR

Vibrations