Geometry & MOs

Info

ID:	198129
PubChem CID:	79053656
Reduced:	ON3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	238.215747
ΔH_f, kcal/mol:	-43.92
Dipole, Da:	5.22
IP(EA), eV:	-8.46(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,2-N,2-trimethyl-1-(1-methylpyrazol-4-yl)-1-N-propylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCN1C=CN=C1C(C(C)(C)N(CC)CC)O

DOS

IR

Vibrations