Geometry & MOs

Info

ID:	205571
PubChem CID:	80121739
Reduced:	SN2O4C14H24 (1)
Stoich.:	AB2C4D14E24 (1)
Weight, g/mol:	282.134142
ΔH_f, kcal/mol:	-158.66
Dipole, Da:	6.61
IP(EA), eV:	-9.34(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[N-(tetrazolo[1,5-b]pyridazin-6-yl)anilino]propanimidamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C(C2CCCC(C2)S(=O)(=O)C)O)OC)C

DOS

IR

Vibrations