Geometry & MOs

Info

ID:	73694
PubChem CID:	48420028
Reduced:	SN3O3H13C15 (1)
Stoich.:	AB3C3D13E15 (1)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	-66.23
Dipole, Da:	7.29
IP(EA), eV:	-9.32(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-dioxoisoindol-5-yl)azepane-1-carboxamide

Drug info:

PubChemData

Smile

C1=CSC(=C1)CCNC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

DOS

IR

Vibrations