Geometry & MOs

Info

ID:	13553
PubChem CID:	246941
Reduced:	ON2H16C21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	312.126263
ΔH_f, kcal/mol:	87.32
Dipole, Da:	5.78
IP(EA), eV:	-8.94(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-3-phenyl-3-pyridin-2-ylprop-2-enenitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=CC=N3)C#N

DOS

IR

Vibrations