Geometry & MOs

Info

ID:	356890
PubChem CID:	127292494
Reduced:	O3N5C19H33 (1)
Stoich.:	A3B5C19D33 (1)
Weight, g/mol:	349.193632
ΔH_f, kcal/mol:	-121.37
Dipole, Da:	4.88
IP(EA), eV:	-8.99(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-prop-2-enylpiperidin-4-yl)-4-(1,3-thiazol-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C=CCN1CCC(CC1)NC(=O)N2CCN(CC2)C(=O)CN3CCOCC3

DOS

IR

Vibrations