Geometry & MOs

Info

ID:	296630
PubChem CID:	117586166
Reduced:	N5C14H25 (1)
Stoich.:	A5B14C25 (1)
Weight, g/mol:	273.93241
ΔH_f, kcal/mol:	-0.93
Dipole, Da:	2.71
IP(EA), eV:	-8.56(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-2-fluorophenyl)thiatriazol-5-amine

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N2CCC(C2)N)NCC(C)(C)C

DOS

IR

Vibrations