Geometry & MOs

Info

ID:	448441
PubChem CID:	135290986
Reduced:	ClNC11H16 (1)
Stoich.:	ABC11D16 (1)
Weight, g/mol:	191.1674
ΔH_f, kcal/mol:	-16.38
Dipole, Da:	2.11
IP(EA), eV:	-9.12(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-5-methyl-4-propan-2-ylpyridine

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1C(C)(C)C)C)Cl

DOS

IR

Vibrations