Geometry & MOs

Info

ID:	227271
PubChem CID:	87560989
Reduced:	N2O4C33H70 (1)
Stoich.:	A2B4C33D70 (1)
Weight, g/mol:	554.502259
ΔH_f, kcal/mol:	-314.17
Dipole, Da:	13.45
IP(EA), eV:	-8.72(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-bis(tripentylazaniumyl)propanedioate

Drug info:

PubChemData

Smile

CCCCC[NH+](CCCCC)CCCCC.CCCCC[NH+](CCCCC)CCCCC.C(C(=O)[O-])C(=O)[O-]

DOS

IR

Vibrations