Geometry & MOs

Info

ID:	203095
PubChem CID:	79778386
Reduced:	O2N5C10H13 (1)
Stoich.:	A2B5C10D13 (1)
Weight, g/mol:	219.11201
ΔH_f, kcal/mol:	3.47
Dipole, Da:	7.95
IP(EA), eV:	-9.75(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-2-methyl-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCC1=C(N=NN1C2=CN(N=C2)C)C(=O)O

DOS

IR

Vibrations