Geometry & MOs

Info

ID:	363176
PubChem CID:	127310215
Reduced:	ON7C14H17 (1)
Stoich.:	AB7C14D17 (1)
Weight, g/mol:	323.185844
ΔH_f, kcal/mol:	73.61
Dipole, Da:	5.29
IP(EA), eV:	-9.08(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C(CCC2)NC3=NC(=O)C4=CNN(C4=N3)C

DOS

IR

Vibrations