Geometry & MOs

Info

ID:	417515
PubChem CID:	135098003
Reduced:	ON6C20H30 (1)
Stoich.:	AB6C20D30 (1)
Weight, g/mol:	372.168522
ΔH_f, kcal/mol:	15.02
Dipole, Da:	0.81
IP(EA), eV:	-8.51(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3R,4R)-3-methoxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidine-1-carbonyl]-2-methyl-6,7-dihydro-5H-1-benzofuran-4-one

Drug info:

PubChemData

Smile

CC1=NN(C=C1CN2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C)CCO

DOS

IR

Vibrations