Geometry & MOs

Info

ID:	146055
PubChem CID:	53628322
Reduced:	N2O3C9H10 (1)
Stoich.:	A2B3C9D10 (1)
Weight, g/mol:	426.158884
ΔH_f, kcal/mol:	8.28
Dipole, Da:	4.86
IP(EA), eV:	-9.72(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1-propylazetidin-3-yl)phenyl]-4-(3,3,3-trifluoropropyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=C(C=C(C=C1)C=NO)[N+](=O)[O-]

DOS

IR

Vibrations