Geometry & MOs

Info

ID:	211540
PubChem CID:	81044341
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	281.156184
ΔH_f, kcal/mol:	-45.46
Dipole, Da:	4.44
IP(EA), eV:	-9.18(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyl-1,3-thiazol-2-yl)methyl]-3-piperidin-3-ylbutanamide

Drug info:

PubChemData

Smile

CC(CC(=O)NCCC1=CC=NC=C1)C2CCCNC2

DOS

IR

Vibrations