Geometry & MOs

Info

ID:	80979
PubChem CID:	49854192
Reduced:	OF2N3C16H29 (1)
Stoich.:	AB2C3D16E29 (1)
Weight, g/mol:	459.190654
ΔH_f, kcal/mol:	-186.8
Dipole, Da:	3.58
IP(EA), eV:	-8.8(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-1,3,4-oxadiazol-2-yl]-(4-phenoxypiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C)[C@H]1CN(CCN1CC(=O)NC2CCC(CC2)(F)F)C

DOS

IR

Vibrations