Geometry & MOs

Info

ID:	444683
PubChem CID:	135263257
Reduced:	NO4H9C11 (1)
Stoich.:	AB4C9D11 (1)
Weight, g/mol:	256.182715
ΔH_f, kcal/mol:	-130.51
Dipole, Da:	2.98
IP(EA), eV:	-9.57(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-benzylideneundec-3-en-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1NC(=O)C2=O)CC(=O)O

DOS

IR

Vibrations