Geometry & MOs

Info

ID:	435183
PubChem CID:	135183466
Reduced:	BrClFSN3H14C15 (1)
Stoich.:	ABCDE3F14G15 (1)
Weight, g/mol:	421.01679
ΔH_f, kcal/mol:	52.13
Dipole, Da:	6.76
IP(EA), eV:	-8.56(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromofuran-2-yl)methyl]-N'-methyl-4-[2-(sulfamoylamino)ethylamino]-1,2,5-oxadiazole-3-carboximidamide

Drug info:

PubChemData

Smile

C=CC(=C)N1CCN(CC1)C2=C3C=C(C(=C(C3=NS2)F)Br)Cl

DOS

IR

Vibrations