Geometry & MOs

Info

ID:	63481
PubChem CID:	26758463
Reduced:	ClNF2O4H14C17 (1)
Stoich.:	ABC2D4E14F17 (1)
Weight, g/mol:	349.112564
ΔH_f, kcal/mol:	-222.1
Dipole, Da:	4.51
IP(EA), eV:	-8.44(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 2,4-difluorobenzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC(=C(C=C1)OC)Cl)OC(=O)C2=C(C=C(C=C2)F)F

DOS

IR

Vibrations