Geometry & MOs

Info

ID:	326575
PubChem CID:	126687814
Reduced:	N2O3C15H20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	467.18837
ΔH_f, kcal/mol:	-119.72
Dipole, Da:	5.96
IP(EA), eV:	-8.72(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-difluoro-1-[[(1R)-1-[(3-methyl-2,3-dihydro-1-benzofuran-6-yl)oxy]-5-(trifluoromethyl)-2,3-dihydro-1H-inden-4-yl]methyl]piperidine

Drug info:

PubChemData

Smile

CCC1=CC(=C(C(=C1)CNC(=O)C=C)O)CNC(=O)C

DOS

IR

Vibrations