Geometry & MOs

Info

ID:	233152
PubChem CID:	87692612
Reduced:	ISCl2O4N6H25C28 (1)
Stoich.:	ABC2D4E6F25G28 (1)
Weight, g/mol:	362.084971
ΔH_f, kcal/mol:	-10.27
Dipole, Da:	12.84
IP(EA), eV:	-8.75(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1=C(C=C2C=CN(C2=C1)C3=NN=C(C=C3)C)N(CC(=O)O)S(=O)(=O)C4=CC(=CC(=C4)Cl)Cl.CC1=NN=C(C=C1)I

DOS

IR

Vibrations