Geometry & MOs

Info

ID:	37434
PubChem CID:	8021035
Reduced:	NO5C17H19 (1)
Stoich.:	AB5C17D19 (1)
Weight, g/mol:	301.167794
ΔH_f, kcal/mol:	-169.88
Dipole, Da:	4.33
IP(EA), eV:	-9.95(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-butylanilino)-2-oxoethyl] (2E,4E)-hexa-2,4-dienoate

Drug info:

PubChemData

Smile

C/C=C/C=C/C(=O)OCC(=O)NCC1=CC=C(C=C1)C(=O)OC

DOS

IR

Vibrations