Geometry & MOs

Info

ID:	14006
PubChem CID:	401455
Reduced:	NS2O3H13C15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	319.033686
ΔH_f, kcal/mol:	17.26
Dipole, Da:	3.18
IP(EA), eV:	-9.04(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-dithiocarboxyoxyphenyl)-N-(2-methoxyphenyl)methanimine oxide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1[N+](=CC2=CC=CC=C2OC(=S)S)[O-]

DOS

IR

Vibrations