Geometry & MOs

Info

ID:	229151
PubChem CID:	87567070
Reduced:	ClO2F4N4H21C23 (1)
Stoich.:	AB2C4D4E21F23 (1)
Weight, g/mol:	201.066864
ΔH_f, kcal/mol:	-208.45
Dipole, Da:	3.92
IP(EA), eV:	-9.72(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxyethylamino)ethanol;silicic acid

Drug info:

PubChemData

Smile

CNC(=O)C(C1=CC=CC=C1)N[C@H](CCC2=CN=C(C=N2)Cl)C3=CC(=C(C=C3)F)OC(F)(F)F

DOS

IR

Vibrations