Geometry & MOs

Info

ID:	330367
PubChem CID:	127247354
Reduced:	O2N5C18H19 (1)
Stoich.:	A2B5C18D19 (1)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	-1.15
Dipole, Da:	5.41
IP(EA), eV:	-9.29(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-indazol-1-yl-1-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)C3=NNC(=O)C4=CC=CC=C43

DOS

IR

Vibrations