Geometry & MOs

Info

ID:	422520
PubChem CID:	135117975
Reduced:	NSO6C15H21 (1)
Stoich.:	ABC6D15E21 (1)
Weight, g/mol:	371.19574
ΔH_f, kcal/mol:	-250.55
Dipole, Da:	6.62
IP(EA), eV:	-9.42(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]butanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC)C)S(=O)(=O)N2CC[C@H]([C@H](C2)C(=O)O)O

DOS

IR

Vibrations