Geometry & MOs

Info

ID:	37363
PubChem CID:	8020200
Reduced:	NO3C19H29 (1)
Stoich.:	AB3C19D29 (1)
Weight, g/mol:	412.130422
ΔH_f, kcal/mol:	-161.17
Dipole, Da:	4.27
IP(EA), eV:	-9.63(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H]1C(=O)OCC(=O)N[C@@H](C)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations