Geometry & MOs

Info

ID:	184761
PubChem CID:	77205048
Reduced:	NO9C29H37 (1)
Stoich.:	AB9C29D37 (1)
Weight, g/mol:	597.314911
ΔH_f, kcal/mol:	-357.71
Dipole, Da:	6.05
IP(EA), eV:	-9.16(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3,4-bis(pentoxycarbonyloxy)phenyl]-2-(3-methylbutan-2-yloxycarbonyloxy)-2-(propan-2-ylamino)propanoic acid

Drug info:

PubChemData

Smile

CCC(C)C(=O)OC1=C(C=C(C=C1)CC(C(=O)OC)NCCOC(=O)OC2=CC=CC=C2)OC(=O)C(C)CC

DOS

IR

Vibrations