Geometry & MOs

Info

ID:	188058
PubChem CID:	77662602
Reduced:	FON2Cl3H20C25 (1)
Stoich.:	ABC2D3E20F25 (1)
Weight, g/mol:	364.195092
ΔH_f, kcal/mol:	-42.41
Dipole, Da:	2.3
IP(EA), eV:	-8.92(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluorophenyl)-(1-prop-2-enylspiro[1,3-dihydroisoquinoline-4,4'-piperidine]-2-yl)methanone

Drug info:

PubChemData

Smile

C1CNCCC12C(N(C3=C2C=C(C=C3)Cl)C(=O)C4=CC=CC=C4F)C5=CC(=C(C=C5)Cl)Cl

DOS

IR

Vibrations