Geometry & MOs

Info

ID:	442473
PubChem CID:	135252321
Reduced:	OH14C24 (2)
Stoich.:	AB14C24 (2)
Weight, g/mol:	293.189198
ΔH_f, kcal/mol:	197.48
Dipole, Da:	3.73
IP(EA), eV:	-8.17(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-6-(4-tert-butylpyridin-2-yl)pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

C1C=CC2=C3C1=CCC4=C(C=CC(=C43)C=C2)C5=C6C=CC=CC6=C(C7=CC=CC=C75)C8=C9C(=CC1=C8OC2=CC=CC=C21)C1=CC=CC=C1O9

DOS

IR

Vibrations