Geometry & MOs

Info

ID:	184747
PubChem CID:	77203457
Reduced:	NO10C29H43 (1)
Stoich.:	AB10C29D43 (1)
Weight, g/mol:	607.335647
ΔH_f, kcal/mol:	-462.66
Dipole, Da:	5.33
IP(EA), eV:	-9.57(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-amino-3-[3,4-bis(3-methylbutoxycarbonyloxy)phenyl]propanoyl]oxybutan-2-yl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CCC(C)OC(=O)OC1=C(C=C(C=C1)C(CC(C)OC(=O)C2CCCCC2)C(C(=O)O)N)OC(=O)OC(C)CC

DOS

IR

Vibrations