Geometry & MOs

Info

ID:	370572
PubChem CID:	127339707
Reduced:	O2N5C20H33 (1)
Stoich.:	A2B5C20D33 (1)
Weight, g/mol:	309.15896
ΔH_f, kcal/mol:	-75.22
Dipole, Da:	9.3
IP(EA), eV:	-8.92(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indazol-7-yl-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCN(CC)C(=O)N1CCC(CC1)C(=O)N2CCC(CC2)C3=CN(N=C3)C

DOS

IR

Vibrations