Geometry & MOs

Info

ID:	254981
PubChem CID:	103129097
Reduced:	BrFON3H11C14 (1)
Stoich.:	ABCD3E11F14 (1)
Weight, g/mol:	276.101111
ΔH_f, kcal/mol:	6.7
Dipole, Da:	3.09
IP(EA), eV:	-9.43(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrazolo[1,5-a]pyrazin-3-yl(quinolin-8-yl)methanol

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)Br)CC(C2=C3C=NC=CN3N=C2)O

DOS

IR

Vibrations