Geometry & MOs

Info

ID:	81537
PubChem CID:	49854839
Reduced:	SN5O6C21H25 (1)
Stoich.:	AB5C6D21E25 (1)
Weight, g/mol:	491.129711
ΔH_f, kcal/mol:	-113.25
Dipole, Da:	5.37
IP(EA), eV:	-9.26(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-hydroxy-3-[[4-(pyrazolo[1,5-a]pyridin-3-ylmethoxy)phenyl]sulfonylamino]-2-thiomorpholin-4-ylpropanamide

Drug info:

PubChemData

Smile

C1COCCN1[C@@H](CNS(=O)(=O)C2=CC=C(C=C2)OCC3=C4C=CC=CN4N=C3)C(=O)NO

DOS

IR

Vibrations