Geometry & MOs

Info

ID:	278696
PubChem CID:	103837079
Reduced:	NSO5C12H17 (1)
Stoich.:	ABC5D12E17 (1)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	-197.67
Dipole, Da:	4.04
IP(EA), eV:	-9.98(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-diethyl-3-[(1R)-2-hydroxy-1-phenylethyl]urea

Drug info:

PubChemData

Smile

CCOC(=O)CS(=O)(=O)N[C@@H](CO)C1=CC=CC=C1

DOS

IR

Vibrations