Geometry & MOs

Info

ID:	54907
PubChem CID:	17389522
Reduced:	NSO4C8H15 (1)
Stoich.:	ABC4D8E15 (1)
Weight, g/mol:	177.128427
ΔH_f, kcal/mol:	-174.94
Dipole, Da:	6.64
IP(EA), eV:	-9.56(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butylpiperidine;hydrochloride

Drug info:

PubChemData

Smile

CSCC1CCCN1.C(=O)(C(=O)O)O

DOS

IR

Vibrations