Geometry & MOs

Info

ID:	436875
PubChem CID:	135212482
Reduced:	O3N8C24H32 (1)
Stoich.:	A3B8C24D32 (1)
Weight, g/mol:	363.033207
ΔH_f, kcal/mol:	31.9
Dipole, Da:	6.34
IP(EA), eV:	-8.8(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-amino-5-(4-chlorophenyl)-4-oxofuran-3-yl] phenylmethanesulfinate

Drug info:

PubChemData

Smile

CC1=C(COC1=O)N(C=C)[C@@H](C)CC2(CCC(CC2)N(C)CC3=CN=C(C=N3)N4C=NN=N4)C=O

DOS

IR

Vibrations