Geometry & MOs

Info

ID:	162323
PubChem CID:	57394296
Reduced:	ClSO2N5C19H26 (1)
Stoich.:	ABC2D5E19F26 (1)
Weight, g/mol:	340.131074
ΔH_f, kcal/mol:	-61.24
Dipole, Da:	6.14
IP(EA), eV:	-9.03(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(4-methoxyphenyl)methyl]-5-oxo-2-phenyloxolane-3-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)Cl)NC2=NC=NC(=C2)NC3CCC(CC3)NS(=O)(=O)C

DOS

IR

Vibrations