Geometry & MOs

Info

ID:	147160
PubChem CID:	53786813
Reduced:	NO5C20H21 (1)
Stoich.:	AB5C20D21 (1)
Weight, g/mol:	407.285801
ΔH_f, kcal/mol:	-176.01
Dipole, Da:	9.07
IP(EA), eV:	-8.91(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-3-sulfanyl-2-(3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenylamino)propanoate

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)C(=O)CCC(=O)N3CCC[C@H]3C(=O)O

DOS

IR

Vibrations