Geometry & MOs

Info

ID:	63304
PubChem CID:	26750552
Reduced:	NF2O4H15C17 (1)
Stoich.:	AB2C4D15E17 (1)
Weight, g/mol:	335.096914
ΔH_f, kcal/mol:	-209.78
Dipole, Da:	4.91
IP(EA), eV:	-9.16(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(3,4-difluoroanilino)-1-oxopropan-2-yl] 3-methoxybenzoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C(C=CC=C1F)F)OC(=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations