Geometry & MOs

Info

ID:	416489
PubChem CID:	135089504
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	346.18567
ΔH_f, kcal/mol:	-83.91
Dipole, Da:	8.16
IP(EA), eV:	-9.1(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-difluoro-4-[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-2-methylquinoline

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CCC(=O)N2CCC3(CC2)C4=C(CCO3)C=C(C=C4)OC

DOS

IR

Vibrations