Geometry & MOs

Info

ID:	206698
PubChem CID:	80286217
Reduced:	BrClO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	262.148141
ΔH_f, kcal/mol:	-94.1
Dipole, Da:	4.31
IP(EA), eV:	-9.01(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(2-fluoro-4-methylphenyl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C=C1)C(C2(CCCO2)C)Cl)Br

DOS

IR

Vibrations