Geometry & MOs

Info

ID:	176256
PubChem CID:	76019620
Reduced:	N2O8C35H60 (1)
Stoich.:	A2B8C35D60 (1)
Weight, g/mol:	664.466267
ΔH_f, kcal/mol:	-433.45
Dipole, Da:	4.43
IP(EA), eV:	-9.44(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-(tetradecylamino)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-8-phenyloctanamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCNC(=O)C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)CCCCCC2=CC=CC=C2

DOS

IR

Vibrations