Geometry & MOs

Info

ID:	240810
PubChem CID:	93617663
Reduced:	NSO5C14H19 (1)
Stoich.:	ABC5D14E19 (1)
Weight, g/mol:	313.098394
ΔH_f, kcal/mol:	-191.08
Dipole, Da:	4.76
IP(EA), eV:	-9.02(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S)-1,1-dioxothiolan-3-yl]-2-[(3-methoxyphenyl)methoxy]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)COCC(=O)N[C@@H]2CCS(=O)(=O)C2

DOS

IR

Vibrations