Geometry & MOs

Info

ID:	28946
PubChem CID:	830827
Reduced:	NO2H13C18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	347.01571
ΔH_f, kcal/mol:	-32.57
Dipole, Da:	2.97
IP(EA), eV:	-9.55(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-bromophenyl)ethylideneamino] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C1=CC=C2C3[C@H]4[C@H](C(C2=C1)C5=CC=CC=C35)C(=O)NC4=O

DOS

IR

Vibrations