Geometry & MOs

Info

ID:	342400
PubChem CID:	127265223
Reduced:	ClNO3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	250.071783
ΔH_f, kcal/mol:	-128.43
Dipole, Da:	3.41
IP(EA), eV:	-9.8(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=CC(=O)NC(C)(CO)CO)C1=CC(=CC=C1)Cl

DOS

IR

Vibrations