Geometry & MOs

Info

ID:	280872
PubChem CID:	103851696
Reduced:	SN2F4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	293.140277
ΔH_f, kcal/mol:	-189.15
Dipole, Da:	5.78
IP(EA), eV:	-8.74(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-fluoro-3-(trifluoromethyl)phenyl]methylamino]-2-methylpentan-2-ol

Drug info:

PubChemData

Smile

C1CSCCN1CCNCC2=CC(=C(C=C2)F)C(F)(F)F

DOS

IR

Vibrations