Geometry & MOs

Info

ID:	202062
PubChem CID:	79622525
Reduced:	O4C11H20 (1)
Stoich.:	A4B11C20 (1)
Weight, g/mol:	280.145678
ΔH_f, kcal/mol:	-203.53
Dipole, Da:	7.18
IP(EA), eV:	-10.16(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-hydroxyethyl-[(1-methylsulfonylpiperidin-3-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

CC(C)(COCC1CCCCO1)C(=O)O

DOS

IR

Vibrations