Geometry & MOs

Info

ID:	351200
PubChem CID:	127279758
Reduced:	O2N3C20H33 (1)
Stoich.:	A2B3C20D33 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-88.29
Dipole, Da:	4.28
IP(EA), eV:	-9.25(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(cyclohexylmethoxy)phenyl]-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1CC(CC(C1)(C)C)CC(=O)N2CCCC(C2)CC3=NOC(=N3)C

DOS

IR

Vibrations