Geometry & MOs

Info

ID:	333813
PubChem CID:	127252365
Reduced:	ON3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	238.179361
ΔH_f, kcal/mol:	-29.97
Dipole, Da:	3.99
IP(EA), eV:	-8.91(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyethyl)-3-methyl-3-(4-methyl-1,2,4-triazol-3-yl)piperidine

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2(CN(CCO2)CC(C)C)C

DOS

IR

Vibrations