Geometry & MOs

Info

ID:	63470
PubChem CID:	26758420
Reduced:	ClF2N2O3H11C15 (1)
Stoich.:	AB2C2D3E11F15 (1)
Weight, g/mol:	341.067506
ΔH_f, kcal/mol:	-172.19
Dipole, Da:	3.15
IP(EA), eV:	-9.23(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations