Geometry & MOs

Info

ID:	32548
PubChem CID:	7843067
Reduced:	BrNO4H14C18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	348.136159
ΔH_f, kcal/mol:	-69.38
Dipole, Da:	6.93
IP(EA), eV:	-9.55(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-ethylphenyl)-2-oxoethyl] 2-naphthalen-2-yloxyacetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)C1=CC=C(C=C1)Br)OC(=O)COC2=CC=C(C=C2)C#N

DOS

IR

Vibrations