Geometry & MOs

Info

ID:	444474
PubChem CID:	135262588
Reduced:	ON2C8H10 (3)
Stoich.:	AB2C8D10 (3)
Weight, g/mol:	490.269239
ΔH_f, kcal/mol:	-11.09
Dipole, Da:	6.07
IP(EA), eV:	-8.76(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[2-methyl-6-[5-methyl-6-[1-(oxetan-3-yl)piperidin-4-yl]indazol-1-yl]pyrimidin-4-yl]-2,5-dioxa-8-azaspiro[3.5]nonane

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C3CCNCC3)N(N=C2)C4=CC(=NC(=N4)OC)N5CCOC6(C5)COC6

DOS

IR

Vibrations