Geometry & MOs

Info

ID:	219981
PubChem CID:	85165110
Reduced:	NO5C38H75 (1)
Stoich.:	AB5C38D75 (1)
Weight, g/mol:	625.10062
ΔH_f, kcal/mol:	-377.73
Dipole, Da:	3.72
IP(EA), eV:	-9.69(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2,4-diacetyloxy-5-[(2-bromoacetyl)amino]-6-(1,2,3-triacetyloxypropyl)oxane-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC(C(=O)NC(CO)C(C(CCCCC=CCCCCCCCCCCCC)O)O)O

DOS

IR

Vibrations