Geometry & MOs

Info

ID:	171850
PubChem CID:	75433587
Reduced:	ClSN2O3C15H23 (1)
Stoich.:	ABC2D3E15F23 (1)
Weight, g/mol:	315.161663
ΔH_f, kcal/mol:	-130.89
Dipole, Da:	1.61
IP(EA), eV:	-9.6(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1-butan-2-ylimidazol-4-yl)sulfonylpiperidin-2-yl]ethanol

Drug info:

PubChemData

Smile

CC(C1CCCCN1S(=O)(=O)N(C)CC2=CC=C(C=C2)Cl)O

DOS

IR

Vibrations