Geometry & MOs

Info

ID:	378075
PubChem CID:	134224146
Reduced:	NF2O2H15C17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	457.040312
ΔH_f, kcal/mol:	-120.44
Dipole, Da:	3.06
IP(EA), eV:	-8.56(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-chloro-1-(4-chlorophenyl)-2-(ethoxymethyl)indol-3-yl]-(3-chlorophenyl)methanone

Drug info:

PubChemData

Smile

CCOC(C1=CC(=C(C=C1)N2C=CC3=C2C(=CC=C3)F)F)O

DOS

IR

Vibrations