Geometry & MOs

Info

ID:	63512
PubChem CID:	26758522
Reduced:	F2N2O4C15H18 (1)
Stoich.:	A2B2C4D15E18 (1)
Weight, g/mol:	314.107813
ΔH_f, kcal/mol:	-274.65
Dipole, Da:	1.28
IP(EA), eV:	-10.0(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 2,4-difluorobenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations