Geometry & MOs

Info

ID:	423078
PubChem CID:	135118882
Reduced:	ON4C23H30 (1)
Stoich.:	AB4C23D30 (1)
Weight, g/mol:	357.168856
ΔH_f, kcal/mol:	-12.74
Dipole, Da:	5.08
IP(EA), eV:	-8.35(-0.31)
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]-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)C(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)C

DOS

IR

Vibrations