Geometry & MOs

Info

ID:	421566
PubChem CID:	135116238
Reduced:	NO5H23C24 (1)
Stoich.:	AB5C23D24 (1)
Weight, g/mol:	304.153541
ΔH_f, kcal/mol:	-134.2
Dipole, Da:	2.8
IP(EA), eV:	-8.9(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dimethyl-1,3-oxazol-5-yl)-[(3S,4R)-3-hydroxy-4-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(C[C@@H]([C@@]1(CC2=CC=CC=C2)C(=O)O)O)C(=O)C3=CC4=CC=CC=C4OC=C3

DOS

IR

Vibrations