Geometry & MOs

Info

ID:	242214
PubChem CID:	96079607
Reduced:	ClFO2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	259.137242
ΔH_f, kcal/mol:	-101.15
Dipole, Da:	3.83
IP(EA), eV:	-8.94(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[4-[(dimethylamino)methyl]phenyl]-(2-fluorophenyl)methanol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)[C@@H](C2=C(C=CC(=C2)Cl)O)O)F

DOS

IR

Vibrations