Geometry & MOs

Info

ID:	288683
PubChem CID:	104323483
Reduced:	SO2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	283.099063
ΔH_f, kcal/mol:	2.57
Dipole, Da:	4.45
IP(EA), eV:	-9.16(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-aminopyridin-4-yl)sulfonyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

C1CC(C2C1CN(C2)CC3=NC(=NO3)C4=CC=CS4)O

DOS

IR

Vibrations