Geometry & MOs

Info

ID:	400981
PubChem CID:	135049613
Reduced:	BOSF4C19H29 (1)
Stoich.:	ABCD4E19F29 (1)
Weight, g/mol:	350.99286
ΔH_f, kcal/mol:	-391.61
Dipole, Da:	20.81
IP(EA), eV:	-10.19(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-5-ethenylphenyl)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.CC(=C)C[S+]1[C@@H](C2CCC1C2)C34CCC(C3(C)C)CC4=O

DOS

IR

Vibrations