Geometry & MOs

Info

ID:	82131
PubChem CID:	49855662
Reduced:	SN2O3C24H24 (1)
Stoich.:	AB2C3D24E24 (1)
Weight, g/mol:	649.245786
ΔH_f, kcal/mol:	-44.2
Dipole, Da:	4.71
IP(EA), eV:	-8.87(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 5-[benzenesulfonyl-(2-oxo-1-phenylpiperidin-3-yl)amino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate

Drug info:

PubChemData

Smile

C1CC(C(=O)N(C1)C2=CC=CC=C2)N(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations