Geometry & MOs

Info

ID:	25147
PubChem CID:	619521
Reduced:	O3H10C16 (1)
Stoich.:	A3B10C16 (1)
Weight, g/mol:	250.006454
ΔH_f, kcal/mol:	-39.09
Dipole, Da:	2.37
IP(EA), eV:	-9.57(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[2-(4-chlorophenyl)ethenyl]pyrimidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)C(=O)O

DOS

IR

Vibrations