Geometry & MOs

Info

ID:	281943
PubChem CID:	103914584
Reduced:	NSO4C10H21 (1)
Stoich.:	ABC4D10E21 (1)
Weight, g/mol:	282.155512
ΔH_f, kcal/mol:	-194.61
Dipole, Da:	5.78
IP(EA), eV:	-9.71(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]oxolan-3-ol

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(C)NCC1(CCOC1)O

DOS

IR

Vibrations