Geometry & MOs

Info

ID:	299311
PubChem CID:	117682590
Reduced:	NOC18H21 (1)
Stoich.:	ABC18D21 (1)
Weight, g/mol:	297.209264
ΔH_f, kcal/mol:	-7.75
Dipole, Da:	1.27
IP(EA), eV:	-8.78(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]pyridine

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)OC2=CC=C(C=C2)C3CCCCC3

DOS

IR

Vibrations