Geometry & MOs

Info

ID:	28003
PubChem CID:	824781
Reduced:	O3C17H18 (1)
Stoich.:	A3B17C18 (1)
Weight, g/mol:	292.121178
ΔH_f, kcal/mol:	-94.16
Dipole, Da:	1.61
IP(EA), eV:	-9.44(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-5-phenoxy-2-phenylpyrimidine

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](C1=CC=CC=C1)[C@H](C2=CC=CC=C2)O

DOS

IR

Vibrations