Geometry & MOs

Info

ID:	1672
PubChem CID:	4853
Reduced:	ON2C22H30 (1)
Stoich.:	AB2C22D30 (1)
Weight, g/mol:	338.235814
ΔH_f, kcal/mol:	-22.16
Dipole, Da:	2.81
IP(EA), eV:	-8.72(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,6-dimethylpiperidin-1-yl)-1-phenyl-1-pyridin-2-ylbutan-1-ol

Drug info:

PubChemData

Smile

CC1CCCC(N1CCCC(C2=CC=CC=C2)(C3=CC=CC=N3)O)C

DOS

IR

Vibrations