Geometry & MOs

Info

ID:	342572
PubChem CID:	127265732
Reduced:	SO2N4H12C16 (1)
Stoich.:	AB2C4D12E16 (1)
Weight, g/mol:	269.062283
ΔH_f, kcal/mol:	109.97
Dipole, Da:	4.32
IP(EA), eV:	-9.44(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(furan-2-yl)-4-(2-pyrazin-2-ylprop-1-enyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CC(=CC1=CSC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])C3=NC=CN=C3

DOS

IR

Vibrations