Geometry & MOs

Info

ID:	190129
PubChem CID:	77959076
Reduced:	FNO7C21H28 (1)
Stoich.:	ABC7D21E28 (1)
Weight, g/mol:	453.381809
ΔH_f, kcal/mol:	-357.29
Dipole, Da:	2.27
IP(EA), eV:	-9.09(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-4-(1-hydroxy-2-methylhexadec-2-enyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CC(CC1=CC=C(C=C1)OC2CC(C2)F)C(=O)O)C(=O)O

DOS

IR

Vibrations