Geometry & MOs

Info

ID:	422783
PubChem CID:	135118401
Reduced:	N2O5C15H24 (1)
Stoich.:	A2B5C15D24 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-232.1
Dipole, Da:	2.17
IP(EA), eV:	-9.58(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-indol-1-yl-1-[(3R,4R)-3-methoxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C[C@@]1(CC2(CCN(CC2)C(=O)C3(CC3)C(=O)N)OC[C@@H]1O)O

DOS

IR

Vibrations