Geometry & MOs

Info

ID:	255460
PubChem CID:	103132190
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	217.132746
ΔH_f, kcal/mol:	74.95
Dipole, Da:	4.87
IP(EA), eV:	-9.01(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-5-methyl-6-(1-methylpyrazol-3-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1NC)C2=NN(C=C2)C

DOS

IR

Vibrations