Geometry & MOs

Info

ID:	196547
PubChem CID:	78846797
Reduced:	SO2N3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	342.205576
ΔH_f, kcal/mol:	-49.52
Dipole, Da:	8.68
IP(EA), eV:	-8.5(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpiperidin-4-yl)-3-methyl-6-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)NC(=O)C2CC2)C(=O)NC3CCN(CC3)C4CC4

DOS

IR

Vibrations