Geometry & MOs

Info

ID:	150745
PubChem CID:	53790441
Reduced:	PO6C16H35 (1)
Stoich.:	AB6C16D35 (1)
Weight, g/mol:	639.305684
ΔH_f, kcal/mol:	-391.84
Dipole, Da:	3.34
IP(EA), eV:	-9.68(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[8-amino-2-hydroxy-5,8-dioxo-3-(pyridin-3-ylmethyl)-6-[(2-quinolin-2-yloxyacetyl)amino]octyl]-N-tert-butylbenzamide

Drug info:

PubChemData

Smile

CCOCCCCCCCC(CCCCOCC)OP(=O)(O)O

DOS

IR

Vibrations