Geometry & MOs

Info

ID:	8660
PubChem CID:	80097
Reduced:	NP2O6C9H23 (1)
Stoich.:	AB2C6D9E23 (1)
Weight, g/mol:	303.100061
ΔH_f, kcal/mol:	-406.49
Dipole, Da:	3.02
IP(EA), eV:	-9.32(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[heptyl(phosphonomethyl)amino]methylphosphonic acid

Drug info:

PubChemData

Smile

CCCCCCCN(CP(=O)(O)O)CP(=O)(O)O

DOS

IR

Vibrations