Geometry & MOs

Info

ID:	366899
PubChem CID:	127321808
Reduced:	NOC13H21 (1)
Stoich.:	ABC13D21 (1)
Weight, g/mol:	388.182064
ΔH_f, kcal/mol:	-62.11
Dipole, Da:	4.2
IP(EA), eV:	-9.12(1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaspiro[5.5]undec-9-en-2-yl-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone

Drug info:

PubChemData

Smile

CCC(=O)N1CCCC2(C1)CCC=CC2

DOS

IR

Vibrations