Geometry & MOs

Info

ID:	417135
PubChem CID:	135091417
Reduced:	N2F3O3C18H21 (1)
Stoich.:	A2B3C3D18E21 (1)
Weight, g/mol:	390.194343
ΔH_f, kcal/mol:	-276.1
Dipole, Da:	5.23
IP(EA), eV:	-9.94(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethoxyphenyl)-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

DOS

IR

Vibrations