Geometry & MOs

Info

ID:	337958
PubChem CID:	127258581
Reduced:	SN2O5C13H16 (1)
Stoich.:	AB2C5D13E16 (1)
Weight, g/mol:	199.024574
ΔH_f, kcal/mol:	-183.47
Dipole, Da:	5.86
IP(EA), eV:	-9.83(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[aminooxy(hydroxy)phosphoryl]oxybutanoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/S(=O)(=O)NC(=O)NCCCC(=O)O

DOS

IR

Vibrations