Geometry & MOs

Info

ID:	184805
PubChem CID:	77210187
Reduced:	NO9C32H49 (1)
Stoich.:	AB9C32D49 (1)
Weight, g/mol:	465.236267
ΔH_f, kcal/mol:	-437.6
Dipole, Da:	5.2
IP(EA), eV:	-9.02(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-(2,2-dimethylpropanoyloxy)-3-[3,4-di(propanoyloxy)phenyl]-4-methylhexanoic acid

Drug info:

PubChemData

Smile

CCCC(C)C(=O)OC1=C(C=C(C=C1)CC(C(=O)OC(C)C(C)OC(=O)OC2CCCCC2)N)OC(=O)C(C)CCC

DOS

IR

Vibrations