Geometry & MOs

Info

ID:	132087
PubChem CID:	51304261
Reduced:	SO2N3C17H21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	284.138559
ΔH_f, kcal/mol:	-54.5
Dipole, Da:	5.83
IP(EA), eV:	-8.92(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[2-(4-methylphenoxy)ethyl]tetrazolo[1,5-b]pyridazin-6-amine

Drug info:

PubChemData

Smile

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC3CCCCNC3=O

DOS

IR

Vibrations