Geometry & MOs

Info

ID:	370175
PubChem CID:	127337630
Reduced:	ON8C18H26 (1)
Stoich.:	AB8C18D26 (1)
Weight, g/mol:	323.19574
ΔH_f, kcal/mol:	38.07
Dipole, Da:	6.75
IP(EA), eV:	-8.8(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-(oxan-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)N(C)C3CCCN(C3)C4=NN=CC=C4

DOS

IR

Vibrations