Geometry & MOs

Info

ID:	371789
PubChem CID:	131271649
Reduced:	FSO3H7C11 (1)
Stoich.:	ABC3D7E11 (1)
Weight, g/mol:	255.027391
ΔH_f, kcal/mol:	-118.21
Dipole, Da:	5.69
IP(EA), eV:	-9.25(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R)-1-amino-2,2-difluoro-3-hydroxypropyl]-3-chloro-6-fluorophenol

Drug info:

PubChemData

Smile

C1=CC2=C(C=C(S2)O)C(=C1C=CC(=O)O)F

DOS

IR

Vibrations