Geometry & MOs

Info

ID:	418925
PubChem CID:	135107140
Reduced:	ON2C9H15 (2)
Stoich.:	AB2C9D15 (2)
Weight, g/mol:	371.153286
ΔH_f, kcal/mol:	-84.65
Dipole, Da:	5.99
IP(EA), eV:	-9.0(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluoro-5-hydroxyphenyl)-(8-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(NN=C1CCC(=O)N2CC[C@]3(CCCN([C@@H]3C2)C)CO)C

DOS

IR

Vibrations