Geometry & MOs

Info

ID:	275575
PubChem CID:	103816640
Reduced:	BrON2F3C14H16 (1)
Stoich.:	ABC2D3E14F16 (1)
Weight, g/mol:	362.98302
ΔH_f, kcal/mol:	-180.02
Dipole, Da:	5.42
IP(EA), eV:	-9.02(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CC1CN(CCN1C(=O)C2=C(C=CC(=C2)C(F)(F)F)Br)C

DOS

IR

Vibrations