Geometry & MOs

Info

ID:	406235
PubChem CID:	135076984
Reduced:	NO2C16H24 (1)
Stoich.:	AB2C16D24 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	-52.33
Dipole, Da:	1.36
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754267
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-1-hydroxy-4-phenylbut-3-en-2-yl]furan-2-carbohydrazide

Drug info:

PubChemData

Smile

CC(C)OC(C#[N+]C(C)(C)C)C1=CC=C(C=C1)OC

DOS

IR

Vibrations