Geometry & MOs

Info

ID:	357967
PubChem CID:	127295467
Reduced:	O2N3C13H21 (1)
Stoich.:	A2B3C13D21 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-11.43
Dipole, Da:	3.12
IP(EA), eV:	-9.08(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-1-(oxan-3-yl)methanamine

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)CC2=NC(=NO2)C3CC3

DOS

IR

Vibrations