Geometry & MOs

Info

ID:	392266
PubChem CID:	135014038
Reduced:	OC14H20 (1)
Stoich.:	AB14C20 (1)
Weight, g/mol:	311.08848
ΔH_f, kcal/mol:	-25.34
Dipole, Da:	3.65
IP(EA), eV:	-9.43(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-butyl-2-methyl-N-(3-methylphenyl)propanamide

Drug info:

PubChemData

Smile

CCCCCCC#CC1=CCCCC1=O

DOS

IR

Vibrations