Geometry & MOs

Info

ID:	431352
PubChem CID:	135171427
Reduced:	O2C13H18 (1)
Stoich.:	A2B13C18 (1)
Weight, g/mol:	569.465539
ΔH_f, kcal/mol:	-71.1
Dipole, Da:	3.77
IP(EA), eV:	-8.44(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[5-(2-carboxy-5-ethyl-5-methylheptan-4-yl)oxypentylamino]-3,3-diethyl-2-(2-ethyl-2-methylbutyl)-6-oxohexanoic acid

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)CCC(=C)C)O

DOS

IR

Vibrations