Geometry & MOs

Info

ID:	196635
PubChem CID:	78856929
Reduced:	ClO2F3N3C15H19 (1)
Stoich.:	AB2C3D3E15F19 (1)
Weight, g/mol:	332.120607
ΔH_f, kcal/mol:	-245.14
Dipole, Da:	6.72
IP(EA), eV:	-8.9(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-fluorophenyl)sulfonyl-methylamino]-N-(1-hydroxypropan-2-yl)butanamide

Drug info:

PubChemData

Smile

CC(CO)NC(=O)C1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

DOS

IR

Vibrations