Geometry & MOs

Info

ID:	175275
PubChem CID:	75877911
Reduced:	ClO3N4C20H23 (1)
Stoich.:	AB3C4D20E23 (1)
Weight, g/mol:	401.164737
ΔH_f, kcal/mol:	-82.45
Dipole, Da:	3.9
IP(EA), eV:	-8.82(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl)urea

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)NC1=CC(=CC=C1)N2CCOC2=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations