Geometry & MOs

Info

ID:	370724
PubChem CID:	127340002
Reduced:	ON4C23H32 (1)
Stoich.:	AB4C23D32 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	-8.64
Dipole, Da:	3.76
IP(EA), eV:	-8.97(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]-[4-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC(CC1)C2=CC=NN2)N3CCC(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations