Geometry & MOs

Info

ID:	358675
PubChem CID:	127296465
Reduced:	O2N3C23H23 (1)
Stoich.:	A2B3C23D23 (1)
Weight, g/mol:	374.174276
ΔH_f, kcal/mol:	-39.84
Dipole, Da:	4.7
IP(EA), eV:	-8.28(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-[2-(1H-indol-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CC3=CC=CC=C3N2)C(=O)C4=CC5=C(C=C4)NC(=O)CC5

DOS

IR

Vibrations