Geometry & MOs

Info

ID:	76000
PubChem CID:	48424284
Reduced:	ClN2O3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	342.157957
ΔH_f, kcal/mol:	-107.0
Dipole, Da:	4.82
IP(EA), eV:	-9.21(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(3-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)NC)OCC2CC2

DOS

IR

Vibrations