Geometry & MOs

Info

ID:	255462
PubChem CID:	103132216
Reduced:	N5C9H11 (1)
Stoich.:	A5B9C11 (1)
Weight, g/mol:	259.179696
ΔH_f, kcal/mol:	81.83
Dipole, Da:	4.59
IP(EA), eV:	-8.98(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-methylpyrazol-3-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CNC1=NC=NC(=C1)C2=NN(C=C2)C

DOS

IR

Vibrations