Geometry & MOs

Info

ID:	280308
PubChem CID:	103848317
Reduced:	NO2F3C13H16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-233.12
Dipole, Da:	3.43
IP(EA), eV:	-9.48(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2-propan-2-yloxyphenyl)methylamino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

C1COCC1(CNCC2=CC=C(C=C2)C(F)(F)F)O

DOS

IR

Vibrations