Geometry & MOs

Info

ID:	230118
PubChem CID:	87570249
Reduced:	ClO2N3C16H24 (1)
Stoich.:	AB2C3D16E24 (1)
Weight, g/mol:	386.266839
ΔH_f, kcal/mol:	-24.84
Dipole, Da:	3.13
IP(EA), eV:	-7.99(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octadecane-4,8,11-tricarboxylic acid

Drug info:

PubChemData

Smile

CCN(C)C=NC1=C(C=C(C(=C1)C)OC/C(=N/OC)/CCl)C

DOS

IR

Vibrations