Geometry & MOs

Info

ID:	81738
PubChem CID:	49855073
Reduced:	NO6C21H31 (1)
Stoich.:	AB6C21D31 (1)
Weight, g/mol:	393.215138
ΔH_f, kcal/mol:	-275.76
Dipole, Da:	4.92
IP(EA), eV:	-10.22(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-12-(6-oxo-2,3-dihydropyran-3-yl)-N-[(3S)-2-oxooxolan-3-yl]dodecanamide

Drug info:

PubChemData

Smile

C1COC(=O)[C@H]1NC(=O)CC(=O)CCCCCCCCCCC2C=CC(=O)O2

DOS

IR

Vibrations