Geometry & MOs

Info

ID:	215064
PubChem CID:	85084081
Reduced:	SN3O8C36H49 (1)
Stoich.:	AB3C8D36E49 (1)
Weight, g/mol:	683.382203
ΔH_f, kcal/mol:	-331.27
Dipole, Da:	3.6
IP(EA), eV:	-8.61(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-benzamido-4-benzoyloxy-5-hexadecyl-2-oxooxolan-3-yl)methyl benzoate

Drug info:

PubChemData

Smile

CC1C(CC=CC=CC=CC(CC(=O)NC2=CC3=C(C(=C2O)CCC=C(C1O)C)SCC(=O)N3)OC)OC(=O)C(C)NC(=O)CC(C)C

DOS

IR

Vibrations