Geometry & MOs

Info

ID:	82658
PubChem CID:	49856295
Reduced:	FN2H6C9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	411.187067
ΔH_f, kcal/mol:	30.01
Dipole, Da:	4.04
IP(EA), eV:	-9.06(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[3-(4-fluoroanilino)-2-(4-fluorophenyl)-8,8-dimethyl-5,6-dihydroimidazo[1,2-a]pyrazin-7-yl]ethanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=C(N3C=CN=CC3=N2)NC4=CC=C(C=C4)F)F

DOS

IR

Vibrations