Geometry & MOs

Info

ID:	13001
PubChem CID:	219919
Reduced:	BrNOC10H20 (1)
Stoich.:	ABCD10E20 (1)
Weight, g/mol:	249.07283
ΔH_f, kcal/mol:	-89.36
Dipole, Da:	1.98
IP(EA), eV:	-9.96(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-heptylpropanamide

Drug info:

PubChemData

Smile

CCCCCCCNC(=O)C(C)Br

DOS

IR

Vibrations