Geometry & MOs

Info

ID:	164379
PubChem CID:	74392054
Reduced:	SSiN2O4C25H28 (1)
Stoich.:	ABC2D4E25F28 (1)
Weight, g/mol:	408.23006
ΔH_f, kcal/mol:	-114.39
Dipole, Da:	4.34
IP(EA), eV:	-8.88(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,7-dimethylocta-2,6-dienyl)-4-hydroxy-2-methoxy-6-(2-phenylethyl)benzoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC3CC(=O)C(=C3C4C2C(=O)N4C5=CC=CC=C5)[Si](C)(C)C

DOS

IR

Vibrations