Geometry & MOs

Info

ID:	131642
PubChem CID:	51238108
Reduced:	ClNSO3C16H16 (1)
Stoich.:	ABCD3E16F16 (1)
Weight, g/mol:	381.00343
ΔH_f, kcal/mol:	-82.44
Dipole, Da:	3.34
IP(EA), eV:	-8.84(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(3,4-dihydro-2H-chromen-3-ylmethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1C(COC2=CC=CC=C21)CNS(=O)(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations