Geometry & MOs

Info

ID:	206054
PubChem CID:	80194365
Reduced:	BrOSN2C13H15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	299.119129
ΔH_f, kcal/mol:	-14.89
Dipole, Da:	2.85
IP(EA), eV:	-8.37(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-hydroxyethyl)-N-[(2-methyloxolan-2-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1(CCCO1)CN2C3=C(C=CC(=C3)Br)NC2=S

DOS

IR

Vibrations