Geometry & MOs

Info

ID:	399097
PubChem CID:	135037747
Reduced:	O2C7H7 (2)
Stoich.:	A2B7C7 (2)
Weight, g/mol:	301.062008
ΔH_f, kcal/mol:	-129.57
Dipole, Da:	5.01
IP(EA), eV:	-9.84(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxooxolan-3-yl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC(=O)[C@@H]1[C@H](COC1=O)C(=C)C2=CC=CC=C2

DOS

IR

Vibrations