Geometry & MOs

Info

ID:	122461
PubChem CID:	50807512
Reduced:	FO2N4C28H35 (1)
Stoich.:	AB2C4D28E35 (1)
Weight, g/mol:	447.268591
ΔH_f, kcal/mol:	-77.17
Dipole, Da:	4.73
IP(EA), eV:	-8.27(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-1-[[1-[(3-fluorophenyl)methyl]indol-2-yl]methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NCCN2CCOCC2)CC3=CC4=CC=CC=C4N3CC5=CC(=CC=C5)F

DOS

IR

Vibrations