Geometry & MOs

Info

ID:

242589

PubChem CID:

97857492

Reduced:

FNOSC16H18 (1)

Stoich.:

ABCDE16F18 (1)

Weight, g/mol:

291.109314

ΔHf, kcal/mol:

-39.08

Dipole, Da:

6.12

IP(EA), eV:

-8.37(-0.35)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[(1R)-1-(2-fluorophenyl)ethyl]-3-[[(R)-methylsulfinyl]methyl]aniline

Drug info:

PubChemData

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C[C@@H](C1=CC=CC=C1F)NC2=CC=CC(=C2)C[S@@](=O)C

DOS

IR

Vibrations