Geometry & MOs

Info

ID:	362166
PubChem CID:	127305855
Reduced:	SO2N3C22H27 (1)
Stoich.:	AB2C3D22E27 (1)
Weight, g/mol:	354.169191
ΔH_f, kcal/mol:	-50.62
Dipole, Da:	7.41
IP(EA), eV:	-8.81(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-pyridin-3-yl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2CCCN(C2)C(=O)CC3=CSC(=N3)CC4=CC=CC=C4

DOS

IR

Vibrations