Geometry & MOs

Info

ID:	414258
PubChem CID:	135087214
Reduced:	N2O2C19H24 (1)
Stoich.:	A2B2C19D24 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-68.0
Dipole, Da:	3.41
IP(EA), eV:	-8.54(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

C1C[C@H]([C@@]2(C1)CCCN(C2)C(=O)CN3C=CC4=CC=CC=C43)O

DOS

IR

Vibrations