Geometry & MOs

Info

ID:	253308
PubChem CID:	103117619
Reduced:	N5C13H19 (1)
Stoich.:	A5B13C19 (1)
Weight, g/mol:	182.153147
ΔH_f, kcal/mol:	71.96
Dipole, Da:	3.98
IP(EA), eV:	-8.92(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-methyl-2-N-[(1-methylpyrazol-3-yl)methyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

C1CCN(C1)CCNCC2=C3C=NC=CN3N=C2

DOS

IR

Vibrations