Geometry & MOs

Info

ID:	416118
PubChem CID:	135089126
Reduced:	NO4C23H27 (1)
Stoich.:	AB4C23D27 (1)
Weight, g/mol:	394.135114
ΔH_f, kcal/mol:	-147.26
Dipole, Da:	3.32
IP(EA), eV:	-9.57(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-4-(spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-1'-carbonyl)-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)C(=O)N2CC[C@]([C@H](C2)O)(CC3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations