Geometry & MOs

Info

ID:	411806
PubChem CID:	135084651
Reduced:	OC14H20 (1)
Stoich.:	AB14C20 (1)
Weight, g/mol:	221.060742
ΔH_f, kcal/mol:	8.14
Dipole, Da:	1.07
IP(EA), eV:	-10.23(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3E)-4-(4-chlorophenyl)buta-1,3-dien-2-yl]acetamide

Drug info:

PubChemData

Smile

C#CC(CCCO)(C#C)C1CCCCC1

DOS

IR

Vibrations