Geometry & MOs

Info

ID:	292287
PubChem CID:	114915374
Reduced:	SN2O3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	195.046633
ΔH_f, kcal/mol:	-125.7
Dipole, Da:	5.2
IP(EA), eV:	-8.63(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)thiophen-3-amine

Drug info:

PubChemData

Smile

CC1=CSC(=C1NC(=O)NC2CCCC2)C(=O)OC

DOS

IR

Vibrations