Geometry & MOs

Info

ID:	369874
PubChem CID:	127336547
Reduced:	SO2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	369.172228
ΔH_f, kcal/mol:	-27.91
Dipole, Da:	5.41
IP(EA), eV:	-8.5(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-4-yl)-2-[(5-piperidin-1-ylsulfonylpyridin-2-yl)amino]ethanol

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1C(=O)C2=CNC3=C2C=CC=N3)C

DOS

IR

Vibrations