Geometry & MOs

Info

ID:	398185
PubChem CID:	135032206
Reduced:	ClN2O2H13C16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	464.987958
ΔH_f, kcal/mol:	-31.28
Dipole, Da:	4.98
IP(EA), eV:	-8.96(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

carbanide;dichlororuthenium(2+);triphenylphosphanium

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C(C(=O)NC3=CC=C(C=C3)Cl)O

DOS

IR

Vibrations