Geometry & MOs

Info

ID:	324368
PubChem CID:	126677524
Reduced:	SN2O4C20H26 (1)
Stoich.:	AB2C4D20E26 (1)
Weight, g/mol:	200.069811
ΔH_f, kcal/mol:	-117.76
Dipole, Da:	5.36
IP(EA), eV:	-8.28(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(E)-2-(4-nitrosophenyl)ethenyl]-1H-1,2,4-triazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CCN(CC2COS(=O)(=O)C)CC3=CC=CC=C3

DOS

IR

Vibrations