Geometry & MOs

Info

ID:	240758
PubChem CID:	93617365
Reduced:	FNSO4C14H18 (1)
Stoich.:	ABCD4E14F18 (1)
Weight, g/mol:	342.104956
ΔH_f, kcal/mol:	-205.93
Dipole, Da:	6.22
IP(EA), eV:	-9.45(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-fluorophenyl)methylsulfonyl]-N-[(3R)-2-oxoazepan-3-yl]acetamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNC(=O)CS(=O)(=O)CC2=CC=C(C=C2)F

DOS

IR

Vibrations