Geometry & MOs

Info

ID:	25163
PubChem CID:	620484
Reduced:	BrS2H11C15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	270.093918
ΔH_f, kcal/mol:	60.06
Dipole, Da:	5.35
IP(EA), eV:	-8.49(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(2-methyl-1H-indol-3-yl)methanimine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=S(S2)Br)C3=CC=CC=C3

DOS

IR

Vibrations