Geometry & MOs

Info

ID:	336021
PubChem CID:	127255028
Reduced:	SN3O3C21H21 (1)
Stoich.:	AB3C3D21E21 (1)
Weight, g/mol:	829.12513
ΔH_f, kcal/mol:	-50.1
Dipole, Da:	3.66
IP(EA), eV:	-8.77(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bromocobalt(2+);pyridine;5,10,15,20-tetraphenylporphyrin-22,24-diide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)NCC2COC3=CC=CC=C3O2)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations