Geometry & MOs

Info

ID:	232333
PubChem CID:	87576002
Reduced:	OSeC11H12 (1)
Stoich.:	ABC11D12 (1)
Weight, g/mol:	457.309313
ΔH_f, kcal/mol:	-18.93
Dipole, Da:	2.73
IP(EA), eV:	-8.28(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3'S,4S)-1-[(2S,4R)-2-cyclohexyl-4-phenylpiperidin-1-yl]spiro[2,3-dihydro-1H-isoquinoline-4,4'-pyrrolidine]-3'-carbaldehyde

Drug info:

PubChemData

Smile

CC(C)OC1=CC2=C(C=C1)C=C[Se]2

DOS

IR

Vibrations