Geometry & MOs

Info

ID:	284591
PubChem CID:	104054052
Reduced:	OBr2Cl2H14C16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	267.162314
ΔH_f, kcal/mol:	-24.09
Dipole, Da:	1.37
IP(EA), eV:	-9.32(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(4-methoxy-2,5-dimethylphenyl)-1,2,3,4-tetrahydroquinoline

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)C(C2=C(C=CC(=C2)Br)Cl)Cl)C)Br

DOS

IR

Vibrations