Geometry & MOs

Info

ID:	145735
PubChem CID:	53583493
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	338.00662
ΔH_f, kcal/mol:	-116.37
Dipole, Da:	3.22
IP(EA), eV:	-8.75(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-bromo-8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1C(=O)NCCN1C(=O)NC2=CC(=CC=C2)OC

DOS

IR

Vibrations