Geometry & MOs

Info

ID:	347077
PubChem CID:	127271581
Reduced:	O2N7C18H27 (1)
Stoich.:	A2B7C18D27 (1)
Weight, g/mol:	352.193297
ΔH_f, kcal/mol:	-24.45
Dipole, Da:	3.14
IP(EA), eV:	-8.84(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

DOS

IR

Vibrations