Geometry & MOs

Info

ID:	131490
PubChem CID:	51212791
Reduced:	NO4C20H23 (1)
Stoich.:	AB4C20D23 (1)
Weight, g/mol:	311.138225
ΔH_f, kcal/mol:	-119.99
Dipole, Da:	3.27
IP(EA), eV:	-8.56(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-1,2-oxazol-3-yl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)CN(C)C(=O)C2=CC3=C(C=C2)OCCCO3

DOS

IR

Vibrations