Geometry & MOs

Info

ID:	57523
PubChem CID:	22401592
Reduced:	NC12H17 (1)
Stoich.:	AB12C17 (1)
Weight, g/mol:	228.027314
ΔH_f, kcal/mol:	-8.51
Dipole, Da:	1.56
IP(EA), eV:	-8.19(0.7)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

bis(carboxymethyl)-(phosphonomethyl)azanium

Drug info:

PubChemData

Smile

CCC1=C(C2=C(CCCC2)C=C1)N

DOS

IR

Vibrations