Geometry & MOs

Info

ID:	296522
PubChem CID:	117581659
Reduced:	BrN2O2S2C7H9 (1)
Stoich.:	AB2C2D2E7F9 (1)
Weight, g/mol:	319.98303
ΔH_f, kcal/mol:	-4.25
Dipole, Da:	3.36
IP(EA), eV:	-9.52(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2-methoxyphenyl)methyl]aziridine-1-sulfonamide

Drug info:

PubChemData

Smile

C1CN1S(=O)(=O)NCC2=CC=C(S2)Br

DOS

IR

Vibrations