Geometry & MOs

Info

ID:	420251
PubChem CID:	135112094
Reduced:	ON2C9H11 (2)
Stoich.:	AB2C9D11 (2)
Weight, g/mol:	407.19574
ΔH_f, kcal/mol:	-23.66
Dipole, Da:	3.43
IP(EA), eV:	-8.65(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-quinolin-4-yl-7-oxa-3,11-diazaspiro[5.6]dodecan-10-one

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1N=C(C=C2)CN3CCN4CCNC(=O)C4C3

DOS

IR

Vibrations