Geometry & MOs

Info

ID:	322719
PubChem CID:	126670897
Reduced:	ClSF2O4N5C28H30 (1)
Stoich.:	ABC2D4E5F28G30 (1)
Weight, g/mol:	362.168916
ΔH_f, kcal/mol:	-137.81
Dipole, Da:	3.35
IP(EA), eV:	-9.3(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R,5R)-3,4,5-triacetyloxy-1-amino-6-(methylamino)hexan-2-yl] acetate

Drug info:

PubChemData

Smile

C/C=C\C(=C)N(CC(=O)N1C[C@@H](C[C@H]1C(=O)NC2=CC=CC(=C2F)C3=C(C=CC(=C3)S(=O)(=O)NC4CC4)Cl)F)N=C

DOS

IR

Vibrations