Geometry & MOs

Info

ID:	63471
PubChem CID:	26758424
Reduced:	NO3F4H11C16 (1)
Stoich.:	AB3C4D11E16 (1)
Weight, g/mol:	341.067506
ΔH_f, kcal/mol:	-268.99
Dipole, Da:	4.1
IP(EA), eV:	-9.13(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2,5-difluoroanilino)-1-oxopropan-2-yl] 2,4-difluorobenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations