Geometry & MOs

Info

ID:	183089
PubChem CID:	76977348
Reduced:	NOF3H10C13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	243.162314
ΔH_f, kcal/mol:	-127.59
Dipole, Da:	7.57
IP(EA), eV:	-9.39(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-propan-2-yl-8-propyl-8H-quinolin-4-one

Drug info:

PubChemData

Smile

CC1=NC2=C(C(=C(C=C2C(=O)C1=C(C)C)F)F)F

DOS

IR

Vibrations