Geometry & MOs

Info

ID:	125323
PubChem CID:	50919962
Reduced:	CuOSN4C10H11 (1)
Stoich.:	ABCD4E10F11 (1)
Weight, g/mol:	539.013701
ΔH_f, kcal/mol:	353.38
Dipole, Da:	24.38
IP(EA), eV:	-8.15(-2.51)
Spin(S_z, S²):	None, None
Charge, e:	3

Chem-info

IUPAC name:

[2-[[2-[bis[[hydroxy(oxoniumylidene)methyl]methyl]amino]cyclohexyl]-[[hydroxy(oxoniumylidene)methyl]methyl]amino]acetyl]oxidanium;dichlororuthenium;hydroxide

Drug info:

PubChemData

Smile

CNC(=S)NNC1=C2C=CC=CC2=[NH+]C1=O.[Cu+2]

DOS

IR

Vibrations