Geometry & MOs

Info

ID:	297469
PubChem CID:	117618587
Reduced:	NC15H17 (1)
Stoich.:	AB15C17 (1)
Weight, g/mol:	269.177964
ΔH_f, kcal/mol:	37.24
Dipole, Da:	2.64
IP(EA), eV:	-9.38(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethylphenyl)-2,2-dimethyl-1-pyridin-2-ylpropan-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1=C(N=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations