Geometry & MOs

Info

ID:	271117
PubChem CID:	103643865
Reduced:	NF3O3C13H16 (1)
Stoich.:	AB3C3D13E16 (1)
Weight, g/mol:	303.144613
ΔH_f, kcal/mol:	-264.8
Dipole, Da:	2.08
IP(EA), eV:	-9.31(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[[3-(trifluoromethoxy)phenyl]methylamino]methyl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

C1COC(CO1)CNCC2=CC(=CC=C2)OC(F)(F)F

DOS

IR

Vibrations