Geometry & MOs

Info

ID:	395353
PubChem CID:	135025249
Reduced:	OC5H7 (2)
Stoich.:	AB5C7 (2)
Weight, g/mol:	241.110279
ΔH_f, kcal/mol:	-32.15
Dipole, Da:	5.75
IP(EA), eV:	-10.42(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,4-dioxan-2-yl)-2-phenylpyridine

Drug info:

PubChemData

Smile

C=CCCC#CC(=O)CCCO

DOS

IR

Vibrations