Geometry & MOs

Info

ID:	414457
PubChem CID:	135087415
Reduced:	N2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	356.192235
ΔH_f, kcal/mol:	-90.23
Dipole, Da:	3.04
IP(EA), eV:	-8.84(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-4-methyl-6-methylsulfanylquinoline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(=O)N2CC[C@]3(CCCN([C@@H]3C2)C)CO

DOS

IR

Vibrations