Geometry & MOs

Info

ID:	423646
PubChem CID:	135119899
Reduced:	N2O5C20H24 (1)
Stoich.:	A2B5C20D24 (1)
Weight, g/mol:	330.194343
ΔH_f, kcal/mol:	-153.25
Dipole, Da:	6.86
IP(EA), eV:	-9.43(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]-1-(3-phenylmethoxypropyl)pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[C@@H]2[C@H](OCC(=O)N2C)C(=O)N(CCO)CC3=CC=CO3

DOS

IR

Vibrations