Geometry & MOs

Info

ID:	351227
PubChem CID:	127279785
Reduced:	O3N5C17H23 (1)
Stoich.:	A3B5C17D23 (1)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-54.07
Dipole, Da:	4.63
IP(EA), eV:	-9.2(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxy-1-adamantyl)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N=C1C)C)C(=O)N2CCCC(C2)CC3=NOC(=N3)C

DOS

IR

Vibrations