Geometry & MOs

Info

ID:	202321
PubChem CID:	79656921
Reduced:	ON2C12H24 (1)
Stoich.:	AB2C12D24 (1)
Weight, g/mol:	225.15896
ΔH_f, kcal/mol:	-70.65
Dipole, Da:	4.6
IP(EA), eV:	-8.66(2.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-propylmorpholin-2-yl)-1H-1,2,4-triazol-5-yl]methanamine

Drug info:

PubChemData

Smile

CNC1(CCC(C1)N2CCCCC2)CO

DOS

IR

Vibrations