Geometry & MOs

Info

ID:	48559
PubChem CID:	11108251
Reduced:	NO2H15C17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	265.110279
ΔH_f, kcal/mol:	-37.04
Dipole, Da:	6.59
IP(EA), eV:	-9.02(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-benzylideneamino]oxy-1-phenylbut-2-yn-1-ol

Drug info:

PubChemData

Smile

C1CC2=C(C=CC=C2NC(=O)C3=CC=CC=C3)C(=O)C1

DOS

IR

Vibrations