Geometry & MOs

Info

ID:	337457
PubChem CID:	127257142
Reduced:	O11C19H36 (1)
Stoich.:	A11B19C36 (1)
Weight, g/mol:	516.413838
ΔH_f, kcal/mol:	-380.35
Dipole, Da:	4.44
IP(EA), eV:	-9.83(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-decan-5-yl-4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane

Drug info:

PubChemData

Smile

CCC(OCCOCC(COCCOC(CC)OOC(=O)CC)O)OOC(=O)CC

DOS

IR

Vibrations