Geometry & MOs

Info

ID:	179943
PubChem CID:	76558287
Reduced:	ClNOPTiC22H31 (1)
Stoich.:	ABCDEF22G31 (1)
Weight, g/mol:	359.012148
ΔH_f, kcal/mol:	8.19
Dipole, Da:	4.68
IP(EA), eV:	-8.27(-2.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chlorotitanium(1+);[5-fluoro-2-(2-hydroxy-3-methylphenyl)phosphanylphenyl]methyl-methylazanide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C(=C1)PC2=CC=CC=C2C[N-]C)O)C(C)(C)C.Cl[Ti+]

DOS

IR

Vibrations