Geometry & MOs

Info

ID:	155639
PubChem CID:	56366510
Reduced:	ON2C12H16 (2)
Stoich.:	AB2C12D16 (2)
Weight, g/mol:	351.198048
ΔH_f, kcal/mol:	-57.02
Dipole, Da:	8.07
IP(EA), eV:	-9.13(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-butyl-4-methyl-1,3-thiazole-5-carbonyl)piperidin-3-yl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1CCCN(C1)C(=O)C2=NN(C3=C2CCCCC3)C4=CC=CC=C4

DOS

IR

Vibrations