Geometry & MOs

Info

ID:	302874
PubChem CID:	124397966
Reduced:	O3N4C8H8 (1)
Stoich.:	A3B4C8D8 (1)
Weight, g/mol:	240.102941
ΔH_f, kcal/mol:	70.35
Dipole, Da:	3.43
IP(EA), eV:	-11.25(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-(6-chloropyridin-2-yl)-(1-methylpiperidin-4-yl)methanol

Drug info:

PubChemData

Smile

CC[C@@]1(C(=NO[C@]1(C#N)[N+](=O)[O-])C#N)C

DOS

IR

Vibrations