Geometry & MOs

Info

ID:	32910
PubChem CID:	7849379
Reduced:	NSO5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	396.135508
ΔH_f, kcal/mol:	-220.66
Dipole, Da:	5.75
IP(EA), eV:	-9.92(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 2-methyl-5-methylsulfonylbenzoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC(=O)NC(C)(C)C

DOS

IR

Vibrations