Geometry & MOs

Info

ID:	31847
PubChem CID:	3720895
Reduced:	NO8C33H45 (1)
Stoich.:	AB8C33D45 (1)
Weight, g/mol:	287.09226
ΔH_f, kcal/mol:	-313.57
Dipole, Da:	5.96
IP(EA), eV:	-8.59(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-benzyl-5-phosphonopentanoic acid

Drug info:

PubChemData

Smile

CC12CCC3C(C1(CCC2C4=CC(=O)OC4)O)CCC5(C3(CCC(C5)O)C=NCC6=CC(=C(C(=C6)OC)OC)OC)O

DOS

IR

Vibrations