Geometry & MOs

Info

ID:	353873
PubChem CID:	127285513
Reduced:	S2N3O3C15H17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	374.110042
ΔH_f, kcal/mol:	-75.92
Dipole, Da:	3.74
IP(EA), eV:	-9.45(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-fluorophenyl)cyclopropyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

DOS

IR

Vibrations