Geometry & MOs

Info

ID:	342133
PubChem CID:	127264846
Reduced:	NBr2O2C9H9 (1)
Stoich.:	AB2C2D9E9 (1)
Weight, g/mol:	236.017497
ΔH_f, kcal/mol:	-12.06
Dipole, Da:	6.37
IP(EA), eV:	-8.83(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-chlorothiophen-2-yl)prop-1-en-2-yl]pyrazine

Drug info:

PubChemData

Smile

CCON/C=C\1/C=C(C=C(C1=O)Br)Br

DOS

IR

Vibrations