Geometry & MOs

Info

ID:	152791
PubChem CID:	56311862
Reduced:	FO2N3C22H28 (1)
Stoich.:	AB2C3D22E28 (1)
Weight, g/mol:	350.146427
ΔH_f, kcal/mol:	-81.14
Dipole, Da:	0.83
IP(EA), eV:	-8.06(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-fluoro-N-propan-2-ylanilino)methyl]-N,N-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)N(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)F

DOS

IR

Vibrations