Geometry & MOs

Info

ID:	443519
PubChem CID:	135259246
Reduced:	O4N5C25H29 (1)
Stoich.:	A4B5C25D29 (1)
Weight, g/mol:	477.237604
ΔH_f, kcal/mol:	-42.44
Dipole, Da:	6.33
IP(EA), eV:	-8.46(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 5-oxo-6-[3-(6-propan-2-yloxypyridin-3-yl)-1H-indazol-5-yl]-2,6-diazaspiro[3.4]octane-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C2C(=O)NC(N2C(=O)C(=C1)NC3=NC=C=C(C4=C3C=CN4C5C(O5)OC(C)(C)C)C)(C)C

DOS

IR

Vibrations