Geometry & MOs

Info

ID:	124370
PubChem CID:	50880771
Reduced:	OBr2Cl2N2H12C15 (1)
Stoich.:	AB2C2D2E12F15 (1)
Weight, g/mol:	401.94015
ΔH_f, kcal/mol:	-27.64
Dipole, Da:	3.1
IP(EA), eV:	-8.55(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-3,5-dibromo-2-ethyl-6-methylphenyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1Br)N)Br)C)NC(=O)C2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations