Geometry & MOs

Info

ID:	363948
PubChem CID:	127313605
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-80.69
Dipole, Da:	4.74
IP(EA), eV:	-9.1(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,3-dimethylpiperidin-1-yl)-(2-methyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(=O)N2CCCC(C2)(C)C

DOS

IR

Vibrations