Geometry & MOs

Info

ID:	179630
PubChem CID:	76514054
Reduced:	O3C18H26 (1)
Stoich.:	A3B18C26 (1)
Weight, g/mol:	242.121927
ΔH_f, kcal/mol:	-87.85
Dipole, Da:	6.75
IP(EA), eV:	-8.8(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-fluorophenyl)ethenyl]-3,5,6-trimethylpyrazine

Drug info:

PubChemData

Smile

CC(C)C1CCC2C=C(C(=C)CC2C1)C3CC(C(=O)O3)O

DOS

IR

Vibrations