Geometry & MOs

Info

ID:	447347
PubChem CID:	135282161
Reduced:	F3O3N4C19H23 (1)
Stoich.:	A3B3C4D19E23 (1)
Weight, g/mol:	351.151368
ΔH_f, kcal/mol:	-249.26
Dipole, Da:	6.86
IP(EA), eV:	-9.66(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-(2-chloro-3-fluoropyridin-4-yl)-2-methylpyridin-3-yl]oxy-2,4-dimethylpentan-2-amine

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)C2=NC(=C(C=C2)OC[C@@H](C)CC(C)(C)NC(=O)O)C(F)(F)F

DOS

IR

Vibrations