Geometry & MOs

Info

ID:	189817
PubChem CID:	77908678
Reduced:	PN2O7C23H49 (1)
Stoich.:	AB2C7D23E49 (1)
Weight, g/mol:	815.685034
ΔH_f, kcal/mol:	-435.05
Dipole, Da:	16.63
IP(EA), eV:	-9.39(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3,4-dihydroxy-15-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexadecan-2-yl]tetracosanamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(C(C(COP(=O)([O-])OCC[N+](C)(C)C)NC=O)O)O

DOS

IR

Vibrations