Geometry & MOs

Info

ID:	280952
PubChem CID:	103852131
Reduced:	ClFON2C13H20 (1)
Stoich.:	ABCD2E13F20 (1)
Weight, g/mol:	225.147727
ΔH_f, kcal/mol:	-88.54
Dipole, Da:	3.66
IP(EA), eV:	-8.67(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

CC(CNCC1=CC(=C(C=C1)F)Cl)(CN(C)C)O

DOS

IR

Vibrations