Geometry & MOs

Info

ID:	399664
PubChem CID:	135041570
Reduced:	N4O13C18H32 (1)
Stoich.:	A4B13C18D32 (1)
Weight, g/mol:	223.076848
ΔH_f, kcal/mol:	-515.36
Dipole, Da:	4.09
IP(EA), eV:	-9.86(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R)-4-azido-3-fluoro-5-[fluoro(methoxy)methyl]oxolan-2-yl]methanol

Drug info:

PubChemData

Smile

C1[C@H]([C@H](C(O[C@]1(C(=O)O)OC2[C@H](C(O[C@H](C2O)OCCCN=[N+]=[N-])CO)O)[C@@H]([C@@H](CO)O)O)N)O

DOS

IR

Vibrations