Geometry & MOs

Info

ID:	178488
PubChem CID:	76336145
Reduced:	SN2O6C26H30 (1)
Stoich.:	AB2C6D26E30 (1)
Weight, g/mol:	193.050395
ΔH_f, kcal/mol:	-225.28
Dipole, Da:	2.78
IP(EA), eV:	-9.41(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-hydroxy-1-oxo-1lambda5-phosphinane-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(=O)SCC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)[C@@H]2C[C@H](CN2C(=O)OCC3=CC=CC=C3)O

DOS

IR

Vibrations