Geometry & MOs

Info

ID:	342921
PubChem CID:	127266084
Reduced:	N5C15H19 (1)
Stoich.:	A5B15C19 (1)
Weight, g/mol:	328.034077
ΔH_f, kcal/mol:	74.37
Dipole, Da:	3.6
IP(EA), eV:	-8.52(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-2-hydroxypropyl]-2-nitro-4-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1NCC3=CC(=NN3C)C

DOS

IR

Vibrations