Geometry & MOs

Info

ID:	43994
PubChem CID:	10322804
Reduced:	OF2N2Cl3H13C23 (1)
Stoich.:	AB2C2D3E13F23 (1)
Weight, g/mol:	476.05023
ΔH_f, kcal/mol:	-40.69
Dipole, Da:	2.58
IP(EA), eV:	-9.58(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-bromo-1-(4-chlorophenyl)-5-methoxy-2-methylindol-3-yl]-2-morpholin-4-ylethanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)Cl)OCC4=CC(=C(C=C4)F)F)Cl

DOS

IR

Vibrations