Geometry & MOs

Info

ID:	262271
PubChem CID:	103281229
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	310.121195
ΔH_f, kcal/mol:	15.66
Dipole, Da:	3.38
IP(EA), eV:	-8.5(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-7-(1-methylpyrazol-4-yl)-3-methylsulfonyl-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC3=NCC(CN3N2)CCO

DOS

IR

Vibrations