Geometry & MOs

Info

ID:	276416
PubChem CID:	103823134
Reduced:	O3N5C9H11 (1)
Stoich.:	A3B5C9D11 (1)
Weight, g/mol:	249.133808
ΔH_f, kcal/mol:	-15.07
Dipole, Da:	4.08
IP(EA), eV:	-10.83(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2,2-trimethyl-3-(tetrazolo[1,5-b]pyridazin-6-ylamino)propanamide

Drug info:

PubChemData

Smile

CCC1=NN=C(O1)CN2C=C(N=N2)C(=O)OC

DOS

IR

Vibrations