Geometry & MOs

Info

ID:	28428
PubChem CID:	827528
Reduced:	N2O3H18C19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	334.153741
ΔH_f, kcal/mol:	-37.37
Dipole, Da:	5.96
IP(EA), eV:	-8.73(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

trimethyl-[4-[[4-(trimethylazaniumyl)phenyl]disulfanyl]phenyl]azanium

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations