Geometry & MOs

Info

ID:	185110
PubChem CID:	77255773
Reduced:	NOH4C5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	215.131014
ΔH_f, kcal/mol:	-26.03
Dipole, Da:	4.67
IP(EA), eV:	-9.02(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-4-methyl-4aH-quinolin-2-one

Drug info:

PubChemData

Smile

CCC1=CC2=NC(=O)C(=O)N=C2C=C1

DOS

IR

Vibrations