Geometry & MOs

Info

ID:	180944
PubChem CID:	76709526
Reduced:	NOYF3H7C14 (1)
Stoich.:	ABCD3E7F14 (1)
Weight, g/mol:	690.149984
ΔH_f, kcal/mol:	-82.27
Dipole, Da:	3.91
IP(EA), eV:	-5.72(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-(2,4-dichlorophenyl)-2-[2-[4-[3-methoxy-4-(2-oxo-2-propan-2-yloxyethyl)phenyl]phenyl]ethenyl]imidazol-1-yl]methyl]-2,3-difluorobenzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=NC3=C(O2)C=[C-]C=C3)C(F)(F)F.[Y]

DOS

IR

Vibrations