Geometry & MOs

Info

ID:	184775
PubChem CID:	77206778
Reduced:	NO10C29H45 (1)
Stoich.:	AB10C29D45 (1)
Weight, g/mol:	539.273047
ΔH_f, kcal/mol:	-471.09
Dipole, Da:	3.94
IP(EA), eV:	-9.46(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-2-[[3,4-bis(2-methylpropoxycarbonyloxy)phenyl]methyl]-4-pentanoyloxybutanoate

Drug info:

PubChemData

Smile

CCCC(=O)OC(C)C(C)OC(=O)C(CC1=CC(=C(C=C1)OC(=O)OC(C)C(C)C)OC(=O)OC(C)C(C)C)N

DOS

IR

Vibrations