Geometry & MOs

Info

ID:	322385
PubChem CID:	126669973
Reduced:	NO3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	274.03686
ΔH_f, kcal/mol:	-130.03
Dipole, Da:	4.55
IP(EA), eV:	-9.02(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-4-(2-fluoro-1-methoxy-3-methylbutan-2-yl)benzene

Drug info:

PubChemData

Smile

C/C(=C\C=C)/C[C@@H](C=O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations