Geometry & MOs

Info

ID:	387623
PubChem CID:	134986208
Reduced:	BrO2C7H15 (1)
Stoich.:	AB2C7D15 (1)
Weight, g/mol:	186.115698
ΔH_f, kcal/mol:	-106.23
Dipole, Da:	4.15
IP(EA), eV:	-9.95(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,E)-3-phenyl-N-[(E)-propylideneamino]prop-2-en-1-imine

Drug info:

PubChemData

Smile

CC[C@@H](C(OC)OCC)Br

DOS

IR

Vibrations