Geometry & MOs

Info

ID:	447340
PubChem CID:	135282135
Reduced:	F3N4O5C26H35 (1)
Stoich.:	A3B4C5D26E35 (1)
Weight, g/mol:	367.187147
ΔH_f, kcal/mol:	-353.59
Dipole, Da:	5.84
IP(EA), eV:	-9.49(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-5-[2-(difluoromethyl)-6-(3-fluoro-2-methylpyridin-4-yl)pyridin-3-yl]oxy-2,4-dimethylpentan-2-amine

Drug info:

PubChemData

Smile

CCN(C1=NC=CC(=N1)C2=CC(=C(C=C2)OCC(C)(CC(C)C)N)C(F)(F)F)C(=O)OC(=O)OC(C)(C)C

DOS

IR

Vibrations