Geometry & MOs

Info

ID:	325697
PubChem CID:	126684546
Reduced:	FON2C16H23 (1)
Stoich.:	ABC2D16E23 (1)
Weight, g/mol:	423.336196
ΔH_f, kcal/mol:	-93.79
Dipole, Da:	4.54
IP(EA), eV:	-8.86(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-[2-[3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-2-yl]-6-(1-propan-2-ylpiperidin-4-yl)pyridine

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC(=C1)CN2CCN(CC2)C(=O)C)F

DOS

IR

Vibrations