Geometry & MOs

Info

ID:	415007
PubChem CID:	135087987
Reduced:	NO2C11H16 (2)
Stoich.:	AB2C11D16 (2)
Weight, g/mol:	370.152872
ΔH_f, kcal/mol:	-160.13
Dipole, Da:	3.88
IP(EA), eV:	-8.43(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4R)-3-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]-(6-methoxy-3-methyl-1-benzofuran-2-yl)methanone

Drug info:

PubChemData

Smile

CN1CCC(CC1)C(=O)N2CCC3(CC2)C4=CC(=C(C=C4CCO3)OC)OC

DOS

IR

Vibrations