Geometry & MOs

Info

ID:	275578
PubChem CID:	103816660
Reduced:	BrNOF3C14H15 (1)
Stoich.:	ABCD3E14F15 (1)
Weight, g/mol:	357.99286
ΔH_f, kcal/mol:	-189.76
Dipole, Da:	4.49
IP(EA), eV:	-9.7(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(5-methylpyridin-3-yl)-5-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CC1(CCC1)CNC(=O)C2=C(C=CC(=C2)C(F)(F)F)Br

DOS

IR

Vibrations