Geometry & MOs

Info

ID:	275863
PubChem CID:	103818500
Reduced:	BrFSN2O2C14H14 (1)
Stoich.:	ABCD2E2F14G14 (1)
Weight, g/mol:	329.140927
ΔH_f, kcal/mol:	-83.77
Dipole, Da:	4.71
IP(EA), eV:	-8.49(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[3-(methanesulfonamido)anilino]ethyl]carbamate

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC=CC(=C1)NCC2=C(C=C(C=C2)F)Br

DOS

IR

Vibrations