Geometry & MOs

Info

ID:	242625
PubChem CID:	97857605
Reduced:	NSO3C16H23 (1)
Stoich.:	ABC3D16E23 (1)
Weight, g/mol:	225.116507
ΔH_f, kcal/mol:	-132.98
Dipole, Da:	3.5
IP(EA), eV:	-8.81(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-4-[(5-fluoro-2-methylphenyl)methylamino]oxolan-3-ol

Drug info:

PubChemData

Smile

C[C@H]1CC(N(C2=CC=CC=C12)C(=O)[C@H](C)S(=O)(=O)C)(C)C

DOS

IR

Vibrations