Geometry & MOs

Info

ID:	437918
PubChem CID:	135227313
Reduced:	FO3N5C13H18 (1)
Stoich.:	AB3C5D13E18 (1)
Weight, g/mol:	469.102509
ΔH_f, kcal/mol:	-136.44
Dipole, Da:	1.47
IP(EA), eV:	-8.94(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-ethyl-6-[3-(1,1,2,2,2-pentafluoroethyl)phenyl]-7H-imidazo[1,2-a]pyrazin-3-ylidene]-3,5-difluorocyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

C[C@]1(C(C(C(C1N2C=NC3=C(N=CN=C32)N)O)O)CCO)F

DOS

IR

Vibrations