Geometry & MOs

Info

ID:	214570
PubChem CID:	85083211
Reduced:	ClSN4O5C26H35 (1)
Stoich.:	ABC4D5E26F35 (1)
Weight, g/mol:	551.10161
ΔH_f, kcal/mol:	-165.33
Dipole, Da:	6.03
IP(EA), eV:	-8.51(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-iodo-5-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Drug info:

PubChemData

Smile

CSC1C(C(C(C(O1)COCC2=CC=C(C=C2)Cl)O)OCC3=CC=CC=C3)NC(=O)CCCN=C(N)N

DOS

IR

Vibrations