Geometry & MOs

Info

ID:	243498
PubChem CID:	99224397
Reduced:	SN2O7C18H24 (1)
Stoich.:	AB2C7D18E24 (1)
Weight, g/mol:	382.03506
ΔH_f, kcal/mol:	-279.77
Dipole, Da:	5.2
IP(EA), eV:	-9.96(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(2S)-1-(N-methylanilino)propan-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CCCC1)NS(=O)(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC

DOS

IR

Vibrations