Geometry & MOs

Info

ID:	273995
PubChem CID:	103806386
Reduced:	BrOSN2C10H13 (1)
Stoich.:	ABCD2E10F13 (1)
Weight, g/mol:	348.01349
ΔH_f, kcal/mol:	15.92
Dipole, Da:	4.64
IP(EA), eV:	-9.39(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)ethyl]-4-fluoro-2-iodobenzamide

Drug info:

PubChemData

Smile

C1CC1NCCNC(=O)C2=CSC(=C2)Br

DOS

IR

Vibrations