Geometry & MOs

Info

ID:	416898
PubChem CID:	135090741
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	306.230728
ΔH_f, kcal/mol:	-73.82
Dipole, Da:	6.29
IP(EA), eV:	-9.08(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(3R,4R)-1-(2-cyclohexylethyl)-4-methoxypyrrolidin-3-yl]methyl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1C(=O)C)NCC2(CCCO2)C

DOS

IR

Vibrations