Geometry & MOs

Info

ID:	381263
PubChem CID:	134971945
Reduced:	NO3C24H31 (1)
Stoich.:	AB3C24D31 (1)
Weight, g/mol:	323.209658
ΔH_f, kcal/mol:	-80.72
Dipole, Da:	2.54
IP(EA), eV:	-9.03(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (4S,5R)-5-(cyclopenten-1-yl)-4-(2,2-dimethylpropyl)-2-oxo-1,3-oxazolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1(OC[C@H](O1)[C@H]([C@@H](CC=C)NCC2=CC=CC=C2)OCC3=CC=CC=C3)C

DOS

IR

Vibrations