Geometry & MOs

Info

ID:	240430
PubChem CID:	93578550
Reduced:	NSCl2O4C20H23 (1)
Stoich.:	ABC2D4E20F23 (1)
Weight, g/mol:	365.139386
ΔH_f, kcal/mol:	-138.29
Dipole, Da:	5.65
IP(EA), eV:	-9.28(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(2-chlorophenoxy)-3-[furan-2-ylmethyl-[[(2S)-oxolan-2-yl]methyl]amino]propan-2-ol

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@@H]1N(CC2=CC=CC=C2Cl)C[C@@H](COC3=CC=CC=C3Cl)O

DOS

IR

Vibrations