Geometry & MOs

Info

ID:	418589
PubChem CID:	135105973
Reduced:	SN3O4C18H21 (1)
Stoich.:	AB3C4D18E21 (1)
Weight, g/mol:	358.169271
ΔH_f, kcal/mol:	-146.87
Dipole, Da:	5.26
IP(EA), eV:	-9.2(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)CC(=O)N2CCC3(CC2)C4=C(CCO3)C=CS4

DOS

IR

Vibrations