Geometry & MOs

Info

ID:	340265
PubChem CID:	127262276
Reduced:	NO3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	413.183838
ΔH_f, kcal/mol:	-135.15
Dipole, Da:	2.65
IP(EA), eV:	-10.3(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-(4-hexoxyphenyl)methylideneamino] 4-ethoxycarbonyloxybenzoate

Drug info:

PubChemData

Smile

CCCCCCCC/C(=N/OC(=O)OCC)/C

DOS

IR

Vibrations