Geometry & MOs

Info

ID:	211441
PubChem CID:	80950628
Reduced:	N5C15H17 (1)
Stoich.:	A5B15C17 (1)
Weight, g/mol:	293.140723
ΔH_f, kcal/mol:	85.09
Dipole, Da:	1.59
IP(EA), eV:	-8.75(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-chloro-3-methylpyrazol-1-yl)-N,2-dipropylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=N1)N2C3=CC=CC=C3C=N2)NC

DOS

IR

Vibrations