Geometry & MOs

Info

ID:	168814
PubChem CID:	75022293
Reduced:	O2N4C9H14 (1)
Stoich.:	A2B4C9D14 (1)
Weight, g/mol:	383.282429
ΔH_f, kcal/mol:	-15.58
Dipole, Da:	3.4
IP(EA), eV:	-9.36(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-6-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-propylamino]hexa-2,4-dienoic acid

Drug info:

PubChemData

Smile

CCCC(=O)ON=C(C1=CN=CN1C)N

DOS

IR

Vibrations