Geometry & MOs

Info

ID:	147534
PubChem CID:	53787190
Reduced:	NOC4H6 (2)
Stoich.:	ABC4D6 (2)
Weight, g/mol:	266.22458
ΔH_f, kcal/mol:	-103.06
Dipole, Da:	5.63
IP(EA), eV:	-9.87(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,8,13-trimethyltetradeca-2,4-dienoic acid

Drug info:

PubChemData

Smile

C1CCN2C(C1)CC(=O)NC2=O

DOS

IR

Vibrations