Geometry & MOs

Info

ID:	288637
PubChem CID:	104322237
Reduced:	FN2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	281.108565
ΔH_f, kcal/mol:	-124.74
Dipole, Da:	3.75
IP(EA), eV:	-9.1(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzylsulfonyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)C(=O)NC3=CC=CC=C3F)O

DOS

IR

Vibrations