Geometry & MOs

Info

ID:	184781
PubChem CID:	77206801
Reduced:	NO9C27H41 (1)
Stoich.:	AB9C27D41 (1)
Weight, g/mol:	581.319997
ΔH_f, kcal/mol:	-426.16
Dipole, Da:	7.0
IP(EA), eV:	-9.11(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-[[3,4-bis(pentan-2-yloxycarbonyloxy)phenyl]methyl]-4-hexanoyloxypentanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations