Geometry & MOs

Info

ID:	120886
PubChem CID:	50748488
Reduced:	ON5C18H29 (1)
Stoich.:	AB5C18D29 (1)
Weight, g/mol:	381.089561
ΔH_f, kcal/mol:	-37.08
Dipole, Da:	2.19
IP(EA), eV:	-8.64(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3Z)-3-(6-methyl-2-oxoquinolin-3-ylidene)-1,2,4-oxadiazol-5-yl]-N-(1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C(C)(C)C)N3CCCC3

DOS

IR

Vibrations