Geometry & MOs

Info

ID:	151228
PubChem CID:	53790928
Reduced:	OC13H18 (1)
Stoich.:	AB13C18 (1)
Weight, g/mol:	432.12125
ΔH_f, kcal/mol:	-43.04
Dipole, Da:	4.84
IP(EA), eV:	-9.41(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-5-but-2-enyl-N-(2,6-diethyl-4-fluorophenyl)-2,6-dimethylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC1=C(C(=C(C=C1)C=O)C)CC

DOS

IR

Vibrations