Geometry & MOs

Info

ID:	297507
PubChem CID:	117619365
Reduced:	N2O6C39H76 (1)
Stoich.:	A2B6C39D76 (1)
Weight, g/mol:	762.648588
ΔH_f, kcal/mol:	-417.4
Dipole, Da:	2.41
IP(EA), eV:	-8.92(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[2-hydroxyethyl(methyl)amino]propanoyl-[2-[(Z)-octadec-9-enoyl]oxyethyl]amino]ethyl (Z)-octadec-9-enoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCCCC)C(=O)CCCN(C)CCO

DOS

IR

Vibrations