Geometry & MOs

Info

ID:	344629
PubChem CID:	127268214
Reduced:	O2N6C13H18 (1)
Stoich.:	A2B6C13D18 (1)
Weight, g/mol:	318.12628
ΔH_f, kcal/mol:	-21.86
Dipole, Da:	6.69
IP(EA), eV:	-8.55(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methyl-1,3-thiazol-2-yl)-2-(4-pyridazin-3-ylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCN2C(=O)CNC2=O)C3=NN=CC=C3

DOS

IR

Vibrations