Geometry & MOs

Info

ID:	350229
PubChem CID:	127277307
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	332.14193
ΔH_f, kcal/mol:	-68.69
Dipole, Da:	6.24
IP(EA), eV:	-8.53(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC2=CC=CC=C21)C(=O)NCC3=CC4=C(C=C3)OCCCO4

DOS

IR

Vibrations