Geometry & MOs

Info

ID:	147660
PubChem CID:	53787317
Reduced:	FOH9C14 (1)
Stoich.:	ABC9D14 (1)
Weight, g/mol:	243.962875
ΔH_f, kcal/mol:	8.54
Dipole, Da:	4.26
IP(EA), eV:	-9.06(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(5-chlorothiophen-2-yl)-5-methylpyrimidine

Drug info:

PubChemData

Smile

CC(=O)C1=CC2=C(C=C1)C3=C2C=C(C=C3)F

DOS

IR

Vibrations