Geometry & MOs

Info

ID:	175274
PubChem CID:	75877910
Reduced:	ClO3N4C20H24 (1)
Stoich.:	AB3C4D20E24 (1)
Weight, g/mol:	402.145868
ΔH_f, kcal/mol:	-60.72
Dipole, Da:	4.44
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.116367
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]urea

Drug info:

PubChemData

Smile

C[NH+](C)C(CNC(=O)NC1=CC(=CC=C1)N2CCOC2=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations