Geometry & MOs

Info

ID:	343226
PubChem CID:	127266399
Reduced:	ON2F3H15C17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	268.142307
ΔH_f, kcal/mol:	-157.35
Dipole, Da:	4.26
IP(EA), eV:	-9.32(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(1,3-dihydroxy-1-pyridin-3-ylpropan-2-yl)carbamate

Drug info:

PubChemData

Smile

C1C(NCC2=CC=CC=C21)C(=O)NC3=CC=CC(=C3)C(F)(F)F

DOS

IR

Vibrations