Geometry & MOs

Info

ID:	438144
PubChem CID:	135227771
Reduced:	NSC5H6 (2)
Stoich.:	ABC5D6 (2)
Weight, g/mol:	742.146209
ΔH_f, kcal/mol:	57.92
Dipole, Da:	1.21
IP(EA), eV:	-8.2(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-[2-[(4-methylphenyl)sulfonylcarbamoyloxy]propanoyloxy]propanoylcarbamoylamino]-1-oxopropan-2-yl] 2-[(4-methylphenyl)sulfonylcarbamoyloxy]propanoate

Drug info:

PubChemData

Smile

CC(C)C1=C2C(=C(S1)SC)N=CC=N2

DOS

IR

Vibrations