Geometry & MOs

Info

ID:	361771
PubChem CID:	127304618
Reduced:	SN2O4C14H24 (1)
Stoich.:	AB2C4D14E24 (1)
Weight, g/mol:	372.095535
ΔH_f, kcal/mol:	-190.59
Dipole, Da:	3.56
IP(EA), eV:	-9.52(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-difluorophenyl)-4-(1,1-dioxo-1,4-thiazepane-4-carbonyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCC1C(=O)N2CCCS(=O)(=O)CC2

DOS

IR

Vibrations