Geometry & MOs

Info

ID:	207082
PubChem CID:	80343121
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	262.204513
ΔH_f, kcal/mol:	-6.08
Dipole, Da:	2.95
IP(EA), eV:	-8.54(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-(4-propylazepan-1-yl)pyridin-4-yl]ethanol

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC(=N1)C)C2=NC=CC(=C2)[C@@H](C)O

DOS

IR

Vibrations