Geometry & MOs

Info

ID:	181296
PubChem CID:	76729114
Reduced:	O3N4C23H24 (1)
Stoich.:	A3B4C23D24 (1)
Weight, g/mol:	502.980431
ΔH_f, kcal/mol:	-14.99
Dipole, Da:	5.01
IP(EA), eV:	-8.46(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dichloro-[[5-fluoro-2-[(4-fluoro-N-(2-oxo-2-propan-2-yloxyethyl)anilino)methyl]phenyl]methylidene]ruthenium

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CNC2=CC3=C(C=C2)OC4C3=NC(=NC4=O)CN5CCC(C5)O

DOS

IR

Vibrations