Geometry & MOs

Info

ID:	306663
PubChem CID:	125165215
Reduced:	NO4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	330.090183
ΔH_f, kcal/mol:	-152.24
Dipole, Da:	3.34
IP(EA), eV:	-8.88(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,4-dichloro-3-methylphenyl)-1-methyl-1-[[(2R)-oxan-2-yl]methyl]urea

Drug info:

PubChemData

Smile

C[C@@H]1CN(CC2=C(O1)C=C(C=C2)OC)CCC(=O)O

DOS

IR

Vibrations