Geometry & MOs

Info

ID:	346107
PubChem CID:	127270595
Reduced:	SO2N6C14H20 (1)
Stoich.:	AB2C6D14E20 (1)
Weight, g/mol:	280.153541
ΔH_f, kcal/mol:	9.58
Dipole, Da:	4.99
IP(EA), eV:	-8.94(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)N2CCN(CC2)CC3=CSC=N3

DOS

IR

Vibrations