Geometry & MOs

Info

ID:	203564
PubChem CID:	79846359
Reduced:	N2S2O3C14H18 (1)
Stoich.:	A2B2C3D14E18 (1)
Weight, g/mol:	229.121512
ΔH_f, kcal/mol:	-99.2
Dipole, Da:	9.33
IP(EA), eV:	-8.28(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]cyclobutan-1-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=C(S2)C(=O)N(C)CCS(=O)(=O)C)N

DOS

IR

Vibrations