Geometry & MOs

Info

ID:	179095
PubChem CID:	76432845
Reduced:	FO3N4C21H27 (1)
Stoich.:	AB3C4D21E27 (1)
Weight, g/mol:	450.263091
ΔH_f, kcal/mol:	-170.08
Dipole, Da:	4.41
IP(EA), eV:	-9.27(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamidoethyl)-5-(2,3-dihydro-1H-inden-5-yloxymethyl)-1-(pyridin-4-ylmethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CC2C(=O)N3CCN(CC3C(=O)N2)C(=O)NC4=CC(=CC=C4)F

DOS

IR

Vibrations