Geometry & MOs

Info

ID:	128397
PubChem CID:	51042833
Reduced:	ClN3O5H14C19 (1)
Stoich.:	AB3C5D14E19 (1)
Weight, g/mol:	467.184506
ΔH_f, kcal/mol:	-8.61
Dipole, Da:	8.31
IP(EA), eV:	-9.01(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzamido-N-[1-(furan-2-ylmethylamino)-1-oxo-3-phenylpropan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=C(O2)/C=N/NC(=O)COC3=CC=C(C=C3)Cl)[N+](=O)[O-]

DOS

IR

Vibrations