Geometry & MOs

Info

ID:	328216
PubChem CID:	126697695
Reduced:	ClNO4H26C27 (1)
Stoich.:	ABC4D26E27 (1)
Weight, g/mol:	440.95341
ΔH_f, kcal/mol:	-86.41
Dipole, Da:	6.18
IP(EA), eV:	-8.7(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-2-[4-chloro-2-(2-hydroxyethoxy)phenyl]-1-(6-chloro-1H-indol-3-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1OC)NC=C2C(=O)CC3=C(C=C(C=C3)Cl)OCCOCC4=CC=CC=C4

DOS

IR

Vibrations