Geometry & MOs

Info

ID:	58505
PubChem CID:	24702085
Reduced:	ClN2O2H11C13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	280.96631
ΔH_f, kcal/mol:	-49.61
Dipole, Da:	2.83
IP(EA), eV:	-8.82(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)N)NC(=O)C2=C(C=CC(=C2)Cl)O

DOS

IR

Vibrations