Geometry & MOs

Info

ID:	360140
PubChem CID:	127300617
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	370.146347
ΔH_f, kcal/mol:	-52.89
Dipole, Da:	4.42
IP(EA), eV:	-9.52(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-methyl-6-thia-1,8-diazatricyclo[7.5.0.03,7]tetradeca-3(7),4,8-trien-2-one

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)C2=NC(=NO2)C3CCCC3

DOS

IR

Vibrations