Geometry & MOs

Info

ID:	167733
PubChem CID:	74866379
Reduced:	OSN6C10H12 (1)
Stoich.:	ABC6D10E12 (1)
Weight, g/mol:	216.07933
ΔH_f, kcal/mol:	103.54
Dipole, Da:	6.25
IP(EA), eV:	-9.22(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-4-(1-methyltetrazol-5-yl)sulfanylbutanimidamide

Drug info:

PubChemData

Smile

CN1C(=NN=N1)SCC2=CC=C(C=C2)C(=NO)N

DOS

IR

Vibrations