Geometry & MOs

Info

ID:	163818
PubChem CID:	74380496
Reduced:	O2N3F6C29H29 (1)
Stoich.:	A2B3C6D29E29 (1)
Weight, g/mol:	713.580569
ΔH_f, kcal/mol:	-350.52
Dipole, Da:	6.49
IP(EA), eV:	-8.73(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptadec-4-en-2-yl]octadecanamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)N2C(CC(C2=O)NC(C)(C)C3=CN=C(C=C3)C(F)(F)F)C4=CC(=CC=C4)OC(F)(F)F

DOS

IR

Vibrations