Geometry & MOs

Info

ID:	345223
PubChem CID:	127268983
Reduced:	O2N7C20H25 (1)
Stoich.:	A2B7C20D25 (1)
Weight, g/mol:	336.136845
ΔH_f, kcal/mol:	40.71
Dipole, Da:	1.92
IP(EA), eV:	-8.67(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)N3CCN(CC3)CC4=NC(=NO4)C

DOS

IR

Vibrations