Geometry & MOs

Info

ID:	224966
PubChem CID:	85735186
Reduced:	SiO2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	299.108835
ΔH_f, kcal/mol:	-83.8
Dipole, Da:	1.57
IP(EA), eV:	-8.86(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexa-2,4-dienyl 2-amino-3-(2-fluorophenyl)propanoate;hydrochloride

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)C1=CC(=CO1)C2CC=CO2

DOS

IR

Vibrations