Geometry & MOs

Info

ID:	190868
PubChem CID:	78070128
Reduced:	NaS2N3O6H36C37 (1)
Stoich.:	AB2C3D6E36F37 (1)
Weight, g/mol:	123.026616
ΔH_f, kcal/mol:	-128.14
Dipole, Da:	7.13
IP(EA), eV:	-8.06(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(CC)C4=CC=C[C-]=C4S(=O)(=O)O)C5=CC(=CC=C5)S(=O)(=O)[O-].[Na+]

DOS

IR

Vibrations