Geometry & MOs

Info

ID:	81444
PubChem CID:	49854733
Reduced:	SN4O5C26H32 (1)
Stoich.:	AB4C5D26E32 (1)
Weight, g/mol:	473.17329
ΔH_f, kcal/mol:	-111.63
Dipole, Da:	5.54
IP(EA), eV:	-8.93(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)S(=O)(=O)NC[C@@H](C(=O)NO)N4CCCCCC4

DOS

IR

Vibrations