Geometry & MOs

Info

ID:	61219
PubChem CID:	26707187
Reduced:	SF2N2O4H20C21 (1)
Stoich.:	AB2C2D4E20F21 (1)
Weight, g/mol:	389.06266
ΔH_f, kcal/mol:	-175.24
Dipole, Da:	2.32
IP(EA), eV:	-8.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)NC(=O)CC2=C(C(=C(C=C2)OC)OC)OC)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations