Geometry & MOs

Info

ID:	196100
PubChem CID:	78780811
Reduced:	ClNO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	415.094425
ΔH_f, kcal/mol:	-40.21
Dipole, Da:	4.03
IP(EA), eV:	-9.09(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-[3-(dimethylamino)propyl]propanamide

Drug info:

PubChemData

Smile

CN(CCOC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations