Geometry & MOs

Info

ID:	355107
PubChem CID:	127288035
Reduced:	N3O3C14H23 (1)
Stoich.:	A3B3C14D23 (1)
Weight, g/mol:	308.083078
ΔH_f, kcal/mol:	-160.03
Dipole, Da:	4.4
IP(EA), eV:	-9.84(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(6-methylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)NCCNC(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations