Geometry & MOs

Info

ID:	403006
PubChem CID:	135058281
Reduced:	NO2C26H27 (1)
Stoich.:	AB2C26D27 (1)
Weight, g/mol:	239.1674
ΔH_f, kcal/mol:	-22.62
Dipole, Da:	2.44
IP(EA), eV:	-8.54(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hexan-2-yl-6-phenylpyridine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)/C=C(/C2=CC=C(C=C2)OC)\N(CC3=CC=CC=C3)C(=O)C)C

DOS

IR

Vibrations