Geometry & MOs

Info

ID:	280297
PubChem CID:	103848260
Reduced:	SN2O3C11H16 (1)
Stoich.:	AB2C3D11E16 (1)
Weight, g/mol:	275.113313
ΔH_f, kcal/mol:	-106.51
Dipole, Da:	3.69
IP(EA), eV:	-9.54(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[[2-(trifluoromethyl)phenyl]methylamino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

C1COCC1(CNCC2=CC(=CS2)C(=O)N)O

DOS

IR

Vibrations