Geometry & MOs

Info

ID:	51302
PubChem CID:	12013948
Reduced:	ClNO3H18C24 (1)
Stoich.:	ABC3D18E24 (1)
Weight, g/mol:	385.0717
ΔH_f, kcal/mol:	-2.19
Dipole, Da:	3.12
IP(EA), eV:	-8.86(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3S,5R)-3-(6-chloro-4-oxochromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carboxylate

Drug info:

PubChemData

Smile

C1[C@H](N(O[C@H]1C2=CC=CC=C2)C3=CC=CC=C3)C4=COC5=C(C4=O)C=C(C=C5)Cl

DOS

IR

Vibrations