Geometry & MOs

Info

ID:	378691
PubChem CID:	134224785
Reduced:	NSC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	268.143645
ΔH_f, kcal/mol:	8.67
Dipole, Da:	0.37
IP(EA), eV:	-8.94(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpyrazol-3-yl)-4-(1-methyl-2H-pyridin-4-yl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC(C)[C@@H]1C[C@H]1C2=CSC(=N2)C3CCCC3

DOS

IR

Vibrations