Geometry & MOs

Info

ID:	240371
PubChem CID:	93578015
Reduced:	FNSO5C24H26 (1)
Stoich.:	ABCD5E24F26 (1)
Weight, g/mol:	331.178358
ΔH_f, kcal/mol:	-180.18
Dipole, Da:	4.31
IP(EA), eV:	-8.8(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@@H]1N(CC2=CC=C(O2)C3=CC=C(C=C3)F)C[C@H](COC4=CC=CC=C4)O

DOS

IR

Vibrations