Geometry & MOs

Info

ID:	420569
PubChem CID:	135114012
Reduced:	ClFON3C14H17 (1)
Stoich.:	ABCD3E14F17 (1)
Weight, g/mol:	377.220223
ΔH_f, kcal/mol:	-56.11
Dipole, Da:	0.96
IP(EA), eV:	-9.12(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dimethoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-2-ethoxy-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCO)CC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations