Geometry & MOs

Info

ID:	150695
PubChem CID:	53790389
Reduced:	SN3O7C20H27 (1)
Stoich.:	AB3C7D20E27 (1)
Weight, g/mol:	438.175499
ΔH_f, kcal/mol:	-266.3
Dipole, Da:	10.39
IP(EA), eV:	-8.93(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CC=C)OC(=O)CNC(=O)C(CS)NC(=O)CCC(C(=O)O)N

DOS

IR

Vibrations