Geometry & MOs

Info

ID:	124907
PubChem CID:	50902368
Reduced:	NaF2N4O8C27H27 (1)
Stoich.:	AB2C4D8E27F27 (1)
Weight, g/mol:	264.99183
ΔH_f, kcal/mol:	-321.27
Dipole, Da:	26.32
IP(EA), eV:	-7.15(-2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-1-amino-2-fluoro-2-[hydroxy(phosphono)methyl]cyclopropane-1-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C(=O)[O-])C(=O)OCOC1=C2C(=O)N3C[C@H]4CCCN4[C@@H]3CN2C=C(C1=O)C(=O)NCC5=C(C=C(C=C5)F)F.[Na+]

DOS

IR

Vibrations