Geometry & MOs

Info

ID:	150696
PubChem CID:	53790390
Reduced:	F2N2O3H24C25 (1)
Stoich.:	A2B2C3D24E25 (1)
Weight, g/mol:	438.175499
ΔH_f, kcal/mol:	-153.21
Dipole, Da:	5.91
IP(EA), eV:	-8.72(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,6R)-6-[2-[4,5-bis(4-fluorophenyl)-2-propan-2-ylimidazol-1-yl]ethenyl]-4-hydroxyoxan-2-one

Drug info:

PubChemData

Smile

CC(C)C1=NC(=C(N1C=C[C@@H]2C[C@H](CC(=O)O2)O)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

DOS

IR

Vibrations