Geometry & MOs

Info

ID:	360411
PubChem CID:	127301056
Reduced:	O2N6C21H28 (1)
Stoich.:	A2B6C21D28 (1)
Weight, g/mol:	393.216475
ΔH_f, kcal/mol:	-6.55
Dipole, Da:	7.94
IP(EA), eV:	-8.87(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-cyclopropyl-3-propyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)CCC3=C(C4=C(NN(C4=NC3=O)C)C)C

DOS

IR

Vibrations