Geometry & MOs

Info

ID:	229506
PubChem CID:	87567869
Reduced:	O3N5F6H17C24 (1)
Stoich.:	A3B5C6D17E24 (1)
Weight, g/mol:	264.006851
ΔH_f, kcal/mol:	-307.09
Dipole, Da:	3.09
IP(EA), eV:	-9.05(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1Z)-1-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethyl]amino]acetic acid;manganese

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=CC(=C2C3=NC4=C(C=C3)C(=NC(=N4)N)NCCOC(=O)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations