Geometry & MOs

Info

ID:	130969
PubChem CID:	51136346
Reduced:	O6C15H20 (1)
Stoich.:	A6B15C20 (1)
Weight, g/mol:	269.152812
ΔH_f, kcal/mol:	-231.5
Dipole, Da:	9.23
IP(EA), eV:	-10.17(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3S)-1-(cyclopropylmethyl)pyrrolidin-3-yl]-5-phenyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C/C=C(\C)/C(=O)O[C@H]1C=CC(=O)O[C@H]1/C=C/[C@@H]([C@@H](C)O)O

DOS

IR

Vibrations