Geometry & MOs

Info

ID:	190361
PubChem CID:	77991862
Reduced:	O5H18C22 (1)
Stoich.:	A5B18C22 (1)
Weight, g/mol:	632.336256
ΔH_f, kcal/mol:	-134.33
Dipole, Da:	1.84
IP(EA), eV:	-10.02(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[7-[(2-benzamido-3-phenylpropanoyl)amino]heptylamino]-1-oxo-3-phenylpropan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CC(=CC2=CC(=CC=C2)C(=O)O)C(=O)C(=CC3=CC(=CC=C3)C(=O)O)C1

DOS

IR

Vibrations