Geometry & MOs

Info

ID:	417664
PubChem CID:	135102404
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	330.149891
ΔH_f, kcal/mol:	-93.91
Dipole, Da:	9.78
IP(EA), eV:	-9.38(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-7-(6-chloro-4-methylquinolin-2-yl)-7-azaspiro[4.5]decan-4-ol

Drug info:

PubChemData

Smile

CC1=CC=C(C(=O)N1C)C(=O)N2C[C@H]([C@H](C2)O)CC3=CC=NC=C3

DOS

IR

Vibrations