Geometry & MOs

Info

ID:	378414
PubChem CID:	134224494
Reduced:	NO5C25H29 (1)
Stoich.:	AB5C25D29 (1)
Weight, g/mol:	193.073893
ΔH_f, kcal/mol:	-190.94
Dipole, Da:	4.23
IP(EA), eV:	-8.73(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(2-aminooxy-4-hydroxyphenyl)but-2-enal

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)COC1CCN(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

DOS

IR

Vibrations