Geometry & MOs

Info

ID:	226063
PubChem CID:	87322622
Reduced:	ClO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	549.997793
ΔH_f, kcal/mol:	-168.28
Dipole, Da:	4.21
IP(EA), eV:	-10.57(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CCC(=O)OC(=O)C1(CCCCC1)Cl

DOS

IR

Vibrations