Geometry & MOs

Info

ID:	378608
PubChem CID:	134224700
Reduced:	N3C12H19 (1)
Stoich.:	A3B12C19 (1)
Weight, g/mol:	468.394046
ΔH_f, kcal/mol:	38.67
Dipole, Da:	1.64
IP(EA), eV:	-8.94(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,2-dimethylpropyl)-6-[2-[6-(2,2-dimethylpropyl)-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl]propyl]-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

Drug info:

PubChemData

Smile

CCC1=NNC2=C1CCN(C2)CC3CC3

DOS

IR

Vibrations