Geometry & MOs

Info

ID:	280213
PubChem CID:	103847650
Reduced:	N2O2F3C13H13 (1)
Stoich.:	A2B2C3D13E13 (1)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	-203.34
Dipole, Da:	7.12
IP(EA), eV:	-9.32(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-methylpyridin-2-yl)amino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

C1COCC1(CNC2=C(C=C(C=C2)C(F)(F)F)C#N)O

DOS

IR

Vibrations