Geometry & MOs

Info

ID:	202058
PubChem CID:	79622499
Reduced:	SN2O4C12H26 (1)
Stoich.:	AB2C4D12E26 (1)
Weight, g/mol:	264.150764
ΔH_f, kcal/mol:	-192.85
Dipole, Da:	5.99
IP(EA), eV:	-9.28(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-methyl-1-(1-methylsulfonylpiperidin-3-yl)butan-2-ol

Drug info:

PubChemData

Smile

COCCNCC(CC1CCCN(C1)S(=O)(=O)C)O

DOS

IR

Vibrations