Geometry & MOs

Info

ID:	29002
PubChem CID:	831056
Reduced:	O2N3H11C16 (1)
Stoich.:	A2B3C11D16 (1)
Weight, g/mol:	323.074678
ΔH_f, kcal/mol:	-27.1
Dipole, Da:	2.52
IP(EA), eV:	-8.88(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-(3-chlorophenyl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C(=C(N2)O)C3=NC4=CC=CC=C4N3

DOS

IR

Vibrations