Geometry & MOs

Info

ID:	17749
PubChem CID:	517099
Reduced:	NO2H15C19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	289.110279
ΔH_f, kcal/mol:	16.2
Dipole, Da:	4.48
IP(EA), eV:	-9.52(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzoyl-6-phenyl-3,4-dihydro-2H-pyran-5-carbonitrile

Drug info:

PubChemData

Smile

C1CC(=C(OC1C(=O)C2=CC=CC=C2)C3=CC=CC=C3)C#N

DOS

IR

Vibrations