Geometry & MOs

Info

ID:	211571
PubChem CID:	81044489
Reduced:	NSO2C14H25 (1)
Stoich.:	ABC2D14E25 (1)
Weight, g/mol:	252.220164
ΔH_f, kcal/mol:	-122.82
Dipole, Da:	6.68
IP(EA), eV:	-8.22(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylpiperidin-1-yl)-3-piperidin-3-ylbutan-1-one

Drug info:

PubChemData

Smile

CC1CC(CS1)N2CCCC(C2)C(C)CC(=O)O

DOS

IR

Vibrations