Geometry & MOs

Info

ID:	432016
PubChem CID:	135172148
Reduced:	ClN3O3C25H34 (1)
Stoich.:	AB3C3D25E34 (1)
Weight, g/mol:	172.040341
ΔH_f, kcal/mol:	-113.56
Dipole, Da:	3.29
IP(EA), eV:	-8.57(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chloropyridin-2-yl)amino]ethanol

Drug info:

PubChemData

Smile

C[C@H](CC(=O)OC)C1=CC(=C(C=C1)N(CC(C)C)C2CCOCC2)NC3=NC=C(C=C3)Cl

DOS

IR

Vibrations