Geometry & MOs

Info

ID:	418082
PubChem CID:	135103491
Reduced:	NO5C21H23 (1)
Stoich.:	AB5C21D23 (1)
Weight, g/mol:	390.194343
ΔH_f, kcal/mol:	-179.58
Dipole, Da:	5.92
IP(EA), eV:	-9.6(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-(1-methylindol-6-yl)methanone

Drug info:

PubChemData

Smile

C1CN(C[C@H]([C@@]1(CC2=CC=CC=C2)C(=O)O)O)C(=O)C3=CC=C(C=C3)CO

DOS

IR

Vibrations