Geometry & MOs

Info

ID:	14990
PubChem CID:	426219
Reduced:	NO5C21H37 (1)
Stoich.:	AB5C21D37 (1)
Weight, g/mol:	383.267173
ΔH_f, kcal/mol:	-259.94
Dipole, Da:	4.86
IP(EA), eV:	-9.82(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-hydroxy-3-(hydroxymethyl)-5-(10-oxohexadec-2-enyl)oxolan-2-one

Drug info:

PubChemData

Smile

CCCCCCC(=O)CCCCCCC=CCC1C(C(C(=O)O1)(CO)N)O

DOS

IR

Vibrations