Geometry & MOs

Info

ID:	290728
PubChem CID:	109863240
Reduced:	IOSN6C22H33 (1)
Stoich.:	ABCD6E22F33 (1)
Weight, g/mol:	333.00343
ΔH_f, kcal/mol:	11.32
Dipole, Da:	8.21
IP(EA), eV:	-8.33(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(2-cyclopropyl-2-hydroxyethyl)-N-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=NN=C(N1C)CN=C(NC2CCOC3(C2)CCSC3)NC(C)C4=CC=CC=C4.I

DOS

IR

Vibrations