Geometry & MOs

Info

ID:	206444
PubChem CID:	80250941
Reduced:	BrSN2C13H15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	225.03944
ΔH_f, kcal/mol:	42.34
Dipole, Da:	3.4
IP(EA), eV:	-8.59(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethylthiophen-2-yl)methyl]-1,2,4-thiadiazol-5-amine

Drug info:

PubChemData

Smile

CCC1=C(SC=C1)CNC2=NC=C(C=C2C)Br

DOS

IR

Vibrations