Geometry & MOs

Info

ID:	140677
PubChem CID:	52740457
Reduced:	F2N2O3C16H16 (1)
Stoich.:	A2B2C3D16E16 (1)
Weight, g/mol:	322.112899
ΔH_f, kcal/mol:	-163.6
Dipole, Da:	3.97
IP(EA), eV:	-9.08(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-(2,4-difluorophenoxy)propan-2-yl]-2-methoxypyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](COC1=C(C=C(C=C1)F)F)NC(=O)C2=C(N=CC=C2)OC

DOS

IR

Vibrations