Geometry & MOs

Info

ID:	185650
PubChem CID:	77325071
Reduced:	FN3O5C21H24 (1)
Stoich.:	AB3C5D21E24 (1)
Weight, g/mol:	441.272653
ΔH_f, kcal/mol:	-227.88
Dipole, Da:	8.01
IP(EA), eV:	-9.44(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-carboxy-2,2-dimethylpropyl)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-oxazolidin-5-yl]-2-methylhex-4-enoic acid

Drug info:

PubChemData

Smile

CC(=O)CC(=O)C1C=C(CCN1)C2=C(C=C(C=C2)N3CC(OC3=O)CNC(=O)C)F

DOS

IR

Vibrations