Geometry & MOs

Info

ID:	378565
PubChem CID:	134224656
Reduced:	NSC10H13 (1)
Stoich.:	ABC10D13 (1)
Weight, g/mol:	411.113153
ΔH_f, kcal/mol:	25.44
Dipole, Da:	3.38
IP(EA), eV:	-8.25(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(2-fluoropyridin-4-yl)-2-(furan-2-ylmethyl)-3-oxo-6-phenyl-7H-imidazo[1,2-a]pyrazine-5-carbonitrile

Drug info:

PubChemData

Smile

CCC(C)C1=CC2=C(N1)C=CS2

DOS

IR

Vibrations