Geometry & MOs

Info

ID:	207081
PubChem CID:	80343042
Reduced:	ClON3C10H10 (1)
Stoich.:	ABC3D10E10 (1)
Weight, g/mol:	271.168462
ΔH_f, kcal/mol:	21.93
Dipole, Da:	4.29
IP(EA), eV:	-9.21(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-[ethyl-[(6-methylpyridin-2-yl)methyl]amino]pyridin-4-yl]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=NC=C1)N2C=C(C=N2)Cl)O

DOS

IR

Vibrations