Geometry & MOs

Info

ID:	392312
PubChem CID:	135014434
Reduced:	O2C11H13 (2)
Stoich.:	A2B11C13 (2)
Weight, g/mol:	371.230788
ΔH_f, kcal/mol:	-152.52
Dipole, Da:	2.75
IP(EA), eV:	-9.96(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3S,4R,5R)-3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-pentan-3-yloxycyclohexene-1-carboxylate

Drug info:

PubChemData

Smile

CCCCC[C@@H](CCOC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

DOS

IR

Vibrations