Geometry & MOs

Info

ID:	287876
PubChem CID:	104297078
Reduced:	NOBr4H9C14 (1)
Stoich.:	ABC4D9E14 (1)
Weight, g/mol:	297.07283
ΔH_f, kcal/mol:	6.66
Dipole, Da:	3.57
IP(EA), eV:	-9.68(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-butan-2-yl-N-ethyl-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2=C(C=C(C=C2Br)Br)Br)Br

DOS

IR

Vibrations