Geometry & MOs

Info

ID:	431100
PubChem CID:	135171170
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	418.211724
ΔH_f, kcal/mol:	-74.79
Dipole, Da:	0.38
IP(EA), eV:	-8.53(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bicyclo[1.1.1]pentanyl)-6-[4-(1H-indazol-5-yloxy)piperidin-1-yl]-5-methylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)COC1=NC=C(C=C1)OC2CCNCC2

DOS

IR

Vibrations