Geometry & MOs

Info

ID:	366250
PubChem CID:	127319707
Reduced:	S2N3O4C14H17 (1)
Stoich.:	A2B3C4D14E17 (1)
Weight, g/mol:	366.124943
ΔH_f, kcal/mol:	-138.27
Dipole, Da:	4.96
IP(EA), eV:	-9.33(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(1,1-dioxothian-3-yl)carbamoyl]phenyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

DOS

IR

Vibrations