Geometry & MOs

Info

ID:	75021
PubChem CID:	48422868
Reduced:	ClNO4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	350.083348
ΔH_f, kcal/mol:	-139.13
Dipole, Da:	7.46
IP(EA), eV:	-8.12(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(3-chloro-4-fluoroanilino)-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)OCC2CC2

DOS

IR

Vibrations