Geometry & MOs

Info

ID:	187675
PubChem CID:	77607195
Reduced:	SN3O8C33H37 (1)
Stoich.:	AB3C8D33E37 (1)
Weight, g/mol:	315.143035
ΔH_f, kcal/mol:	-253.28
Dipole, Da:	4.77
IP(EA), eV:	-9.2(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-hydroxy-1-morpholin-4-yl-1-oxobutan-2-yl)-2-oxopyrrolidin-3-yl]carbamic acid

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)N2CC(OC2=O)C(=O)NC(CC3=CC=CC=C3)C(CN(CC4CC4)S(=O)(=O)C5=CC=CC(=C5)OC)O

DOS

IR

Vibrations