Geometry & MOs

Info

ID:	370207
PubChem CID:	127337740
Reduced:	OSN6C18H26 (1)
Stoich.:	ABC6D18E26 (1)
Weight, g/mol:	361.193632
ΔH_f, kcal/mol:	6.16
Dipole, Da:	6.38
IP(EA), eV:	-8.72(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethylimidazol-1-yl)-N-[1-(2-ethyl-1,3-thiazol-4-yl)ethyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)C(C)NC(=O)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations