Geometry & MOs

Info

ID:	240809
PubChem CID:	93617657
Reduced:	SN3O3C15H17 (1)
Stoich.:	AB3C3D15E17 (1)
Weight, g/mol:	313.098394
ΔH_f, kcal/mol:	-70.16
Dipole, Da:	4.13
IP(EA), eV:	-9.1(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN(C=C1)C2=CC=C(C=C2)C(=O)N[C@@H]3CCS(=O)(=O)C3

DOS

IR

Vibrations