Geometry & MOs

Info

ID:	176852
PubChem CID:	76105555
Reduced:	O2C11H17 (2)
Stoich.:	A2B11C17 (2)
Weight, g/mol:	462.226705
ΔH_f, kcal/mol:	-178.42
Dipole, Da:	8.15
IP(EA), eV:	-10.02(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-amino-3-hydroxy-5-(1-hydroxycyclopentyl)-6-oxo-1-phenylhexan-2-yl]quinoxaline-2-carboxamide

Drug info:

PubChemData

Smile

CCCCC(CCCC1CCC(=O)C1CCCCC=CC(=O)O)(C#C)O

DOS

IR

Vibrations