Geometry & MOs

Info

ID:	388674
PubChem CID:	134989841
Reduced:	PN2H7C8 (1)
Stoich.:	AB2C7D8 (1)
Weight, g/mol:	177.020812
ΔH_f, kcal/mol:	61.76
Dipole, Da:	1.71
IP(EA), eV:	-9.4(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-5-methylsulfonyltriazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NPC=N2

DOS

IR

Vibrations