Geometry & MOs

Info

ID:	382724
PubChem CID:	134974045
Reduced:	O5C16H24 (1)
Stoich.:	A5B16C24 (1)
Weight, g/mol:	305.162708
ΔH_f, kcal/mol:	-159.49
Dipole, Da:	4.23
IP(EA), eV:	-9.27(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-(3-hydroxy-3-methyl-1-phenylbutyl)-2-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(=CCC1[C@@](O1)(C)[C@]2([C@@H](C(=O)CCC23CO3)OC)O)C

DOS

IR

Vibrations