Geometry & MOs

Info

ID:	363905
PubChem CID:	127313562
Reduced:	NSO3C11H21 (1)
Stoich.:	ABC3D11E21 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-162.63
Dipole, Da:	7.61
IP(EA), eV:	-9.68(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,3-dimethylpiperidin-1-yl)-(4-methyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC(C1)(C)C)S(=O)(=O)C

DOS

IR

Vibrations