Geometry & MOs

Info

ID:	281929
PubChem CID:	103914567
Reduced:	NSO3C13H27 (1)
Stoich.:	ABC3D13E27 (1)
Weight, g/mol:	270.267114
ΔH_f, kcal/mol:	-168.43
Dipole, Da:	4.18
IP(EA), eV:	-9.06(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[[[1-(2-methylpropyl)piperidin-4-yl]amino]methyl]butan-1-ol

Drug info:

PubChemData

Smile

CCC(CC)(CNC1CCCC1S(=O)(=O)C)CO

DOS

IR

Vibrations