Geometry & MOs

Info

ID:	74896
PubChem CID:	48422660
Reduced:	ClNO4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	387.159434
ΔH_f, kcal/mol:	-139.09
Dipole, Da:	3.23
IP(EA), eV:	-8.3(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations