Geometry & MOs

Info

ID:	195868
PubChem CID:	78744463
Reduced:	SN3O3C16H17 (1)
Stoich.:	AB3C3D16E17 (1)
Weight, g/mol:	414.179087
ΔH_f, kcal/mol:	-80.18
Dipole, Da:	5.45
IP(EA), eV:	-8.65(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-methoxyanilino)-1-oxopropan-2-yl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Drug info:

PubChemData

Smile

CC1=NSC(=C1C(=O)OC(C)C(=O)N2CCC3=CC=CC=C32)N

DOS

IR

Vibrations