Geometry & MOs

Info

ID:	59874
PubChem CID:	24901975
Reduced:	ClFN2O2H6C11 (1)
Stoich.:	ABC2D2E6F11 (1)
Weight, g/mol:	330.032668
ΔH_f, kcal/mol:	-62.18
Dipole, Da:	3.7
IP(EA), eV:	-10.68(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-(3-chloro-4-phenylmethoxyphenyl)pyrimidine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C2=NC(=NC=C2)Cl)F)C(=O)O

DOS

IR

Vibrations