Geometry & MOs

Info

ID:	178671
PubChem CID:	76365982
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	-141.75
Dipole, Da:	3.13
IP(EA), eV:	-8.85(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7-dimethyl-3-[4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carbonyl]-6,8-dihydro-3H-quinoline-2,5-dione

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)C2C=C3C(=NC2=O)CC(CC3=O)(C)C

DOS

IR

Vibrations