Geometry & MOs

Info

ID:	362752
PubChem CID:	127309298
Reduced:	ON5C19H33 (1)
Stoich.:	AB5C19D33 (1)
Weight, g/mol:	379.240582
ΔH_f, kcal/mol:	-40.36
Dipole, Da:	3.89
IP(EA), eV:	-8.69(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-methyl-1,3-thiazol-5-yl)methyl]-N-[(1-propylpiperidin-4-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)CNC(=O)N2CCCC(C2)N3C=C(C=N3)C

DOS

IR

Vibrations