Geometry & MOs

Info

ID:	347814
PubChem CID:	127272876
Reduced:	N2S2O3C19H28 (1)
Stoich.:	A2B2C3D19E28 (1)
Weight, g/mol:	272.099477
ΔH_f, kcal/mol:	-115.25
Dipole, Da:	7.1
IP(EA), eV:	-9.33(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,4-dimethylpiperidin-1-yl)sulfonyl-5-fluoropyridine

Drug info:

PubChemData

Smile

CC(=O)NCC1=CC=C(S1)S(=O)(=O)N2CCCC2CC3CC4CCC3C4

DOS

IR

Vibrations