Geometry & MOs

Info

ID:	305914
PubChem CID:	124974103
Reduced:	FON2C27H29 (1)
Stoich.:	ABC2D27E29 (1)
Weight, g/mol:	351.169525
ΔH_f, kcal/mol:	-44.46
Dipole, Da:	3.28
IP(EA), eV:	-9.23(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxypyridin-3-yl)-[(2R)-2-(7-methylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CCCC(=O)N2CCC[C@@H]2C3=NC=C(C=C3)CC4=CC=CC=C4)F

DOS

IR

Vibrations