Geometry & MOs

Info

ID:	37364
PubChem CID:	8020212
Reduced:	SN2O7C18H24 (1)
Stoich.:	AB2C7D18E24 (1)
Weight, g/mol:	412.130422
ΔH_f, kcal/mol:	-246.21
Dipole, Da:	7.25
IP(EA), eV:	-8.94(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methoxy-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] (1S,2R)-2-methylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]1C(=O)OCC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations