Geometry & MOs

Info

ID:	233978
PubChem CID:	92297462
Reduced:	NS2C10H19 (1)
Stoich.:	AB2C10D19 (1)
Weight, g/mol:	303.163457
ΔH_f, kcal/mol:	-22.02
Dipole, Da:	6.15
IP(EA), eV:	-8.59(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[benzyl(ethyl)amino]-3-(2-fluorophenoxy)propan-2-ol

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CC(C1)(C)C)NC(=S)S

DOS

IR

Vibrations