Geometry & MOs

Info

ID:	376559
PubChem CID:	134222578
Reduced:	F2O2N5H13C21 (1)
Stoich.:	A2B2C5D13E21 (1)
Weight, g/mol:	417.099252
ΔH_f, kcal/mol:	-1.45
Dipole, Da:	2.59
IP(EA), eV:	-8.46(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-aminophenyl)-8-(2-chloropyridin-4-yl)-2-(furan-2-ylmethyl)-7H-imidazo[1,2-a]pyrazin-3-one

Drug info:

PubChemData

Smile

C1=COC(=C1)CC2=NC3=C(NC(=CN3C2=O)C4=CC(=NC=C4)F)C5=CC(=NC=C5)F

DOS

IR

Vibrations