Geometry & MOs

Info

ID:	1038
PubChem CID:	3699
Reduced:	NP2O6C8H19 (1)
Stoich.:	AB2C6D8E19 (1)
Weight, g/mol:	287.068761
ΔH_f, kcal/mol:	-393.17
Dipole, Da:	5.64
IP(EA), eV:	-9.82(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(cycloheptylamino)-phosphonomethyl]phosphonic acid

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(P(=O)(O)O)P(=O)(O)O

DOS

IR

Vibrations