Geometry & MOs

Info

ID:	343357
PubChem CID:	127266530
Reduced:	ON3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	250.071783
ΔH_f, kcal/mol:	68.21
Dipole, Da:	5.48
IP(EA), eV:	-9.25(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3,4,5-trifluorophenyl)prop-1-en-2-yl]pyrazine

Drug info:

PubChemData

Smile

CC(=CC1=CC(=C(C=C1)OC)C#N)C2=NC=CN=C2

DOS

IR

Vibrations