Geometry & MOs

Info

ID:	179072
PubChem CID:	76429534
Reduced:	F3N4O4C23H23 (1)
Stoich.:	A3B4C4D23E23 (1)
Weight, g/mol:	468.277678
ΔH_f, kcal/mol:	-281.79
Dipole, Da:	3.57
IP(EA), eV:	-9.02(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(2,3-dihydro-1H-inden-5-yloxymethyl)-1-(naphthalen-2-ylmethyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2C(=O)N3CC(CC3C(=O)N2)NC(=O)NC4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations