Geometry & MOs

Info

ID:	229312
PubChem CID:	87567394
Reduced:	NSO5C12H25 (1)
Stoich.:	ABC5D12E25 (1)
Weight, g/mol:	235.05718
ΔH_f, kcal/mol:	-227.14
Dipole, Da:	14.22
IP(EA), eV:	-9.91(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-diethylpiperidin-1-ium-3-one;bromide

Drug info:

PubChemData

Smile

CC(C)[N+]1(CCC(=O)CC1)C(C)C.COS(=O)(=O)[O-]

DOS

IR

Vibrations