Geometry & MOs

Info

ID:	193947
PubChem CID:	78459495
Reduced:	NO5C24H27 (1)
Stoich.:	AB5C24D27 (1)
Weight, g/mol:	399.170216
ΔH_f, kcal/mol:	-180.96
Dipole, Da:	8.12
IP(EA), eV:	-8.86(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

dimethyl-[2-[[2-[[3-(4-methylphenyl)sulfonyl-1,3-oxazolidin-2-yl]methylamino]-2-oxoacetyl]amino]ethyl]azanium

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2N1C(=O)C(C)OC(=O)CCCOC3=CC=C(C=C3)C(=O)C

DOS

IR

Vibrations