Geometry & MOs

Info

ID:	149979
PubChem CID:	53789662
Reduced:	FN2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	383.170828
ΔH_f, kcal/mol:	-43.88
Dipole, Da:	1.0
IP(EA), eV:	-9.1(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-2-[[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]amino]-1-[3-(trifluoromethyl)phenyl]ethanol

Drug info:

PubChemData

Smile

C1CNCC(C1C2=CC=C(C=C2)F)CCCN

DOS

IR

Vibrations