Geometry & MOs

Info

ID:	342365
PubChem CID:	127265188
Reduced:	SN4H12C15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	236.017497
ΔH_f, kcal/mol:	124.17
Dipole, Da:	1.92
IP(EA), eV:	-8.8(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(5-chlorothiophen-2-yl)prop-1-en-2-yl]pyrazine

Drug info:

PubChemData

Smile

CC(=CC1=CSC(=N1)C2=CC=CC=N2)C3=NC=CN=C3

DOS

IR

Vibrations