Geometry & MOs

Info

ID:	348251
PubChem CID:	127273316
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	338.130028
ΔH_f, kcal/mol:	13.33
Dipole, Da:	6.71
IP(EA), eV:	-8.98(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-chromen-4-yl)-2-[(1,1-dioxothiolan-3-yl)-methylamino]acetamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3CN4CC5(CC4CC(C5)(C)C)C

DOS

IR

Vibrations