Geometry & MOs

Info

ID:	423412
PubChem CID:	135119461
Reduced:	ON2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	324.220164
ΔH_f, kcal/mol:	-8.35
Dipole, Da:	6.79
IP(EA), eV:	-9.22(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)CN(C)[C@@H]3C[C@@H]4CC(=O)N(C[C@@H]4C3)C

DOS

IR

Vibrations