Geometry & MOs

Info

ID:	191147
PubChem CID:	78111687
Reduced:	OF3N5C25H26 (1)
Stoich.:	AB3C5D25E26 (1)
Weight, g/mol:	475.180679
ΔH_f, kcal/mol:	-44.08
Dipole, Da:	9.1
IP(EA), eV:	-8.87(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,4-trifluoro-N-propan-2-yl-N-[2-[5-[2-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]ethenyl]benzimidazol-1-yl]ethyl]butan-1-amine

Drug info:

PubChemData

Smile

CCCN(CCC1=CC=CC=C1)CCN2C=NC3=C2C=CC(=C3)C=CC4=NOC(=N4)C(F)(F)F

DOS

IR

Vibrations