Geometry & MOs

Info

ID:	210893
PubChem CID:	80868835
Reduced:	ON6C13H18 (1)
Stoich.:	AB6C13D18 (1)
Weight, g/mol:	246.122909
ΔH_f, kcal/mol:	44.5
Dipole, Da:	5.94
IP(EA), eV:	-9.0(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(ethylamino)-5-methylpyrimidin-4-yl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC1=CN=CC(=N1)N2C=CC(=N2)C(=O)N(C)C

DOS

IR

Vibrations