Geometry & MOs

Info

ID:	406820
PubChem CID:	135078721
Reduced:	SiO6C32H54 (1)
Stoich.:	AB6C32D54 (1)
Weight, g/mol:	333.077677
ΔH_f, kcal/mol:	-343.56
Dipole, Da:	2.53
IP(EA), eV:	-8.66(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-fluoro-2-(trifluoromethyl)phenyl]-(4-pyrrol-1-ylphenyl)methanone

Drug info:

PubChemData

Smile

CC[C@H](CC1C(CCC2(O1)CC(=O)C(C(O2)CCOCC3=CC=C(C=C3)OC)C)C)O[Si](CC)(CC)C(C)C

DOS

IR

Vibrations