Geometry & MOs

Info

ID:	404450
PubChem CID:	135066309
Reduced:	N2S2O5H20C21 (1)
Stoich.:	A2B2C5D20E21 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-96.69
Dipole, Da:	4.7
IP(EA), eV:	-9.04(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1/C=C/S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=N3

DOS

IR

Vibrations