Geometry & MOs

Info

ID:	176283
PubChem CID:	76025406
Reduced:	ClSO4N5C21H26 (1)
Stoich.:	ABC4D5E21F26 (1)
Weight, g/mol:	1649.476703
ΔH_f, kcal/mol:	-48.07
Dipole, Da:	5.51
IP(EA), eV:	-8.27(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[NH+]1C(NNC1SCC(=O)NN=CC2=CC(=C(C(=C2)OC)[O-])OC)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations