Geometry & MOs

Info

ID:	311006
PubChem CID:	126588789
Reduced:	ClN2O3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-74.04
Dipole, Da:	3.83
IP(EA), eV:	-8.1(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(4-ethyl-2,5-dimethylphenoxy)methyl]-3-methylphenyl]-1-hydroxy-3-methylurea

Drug info:

PubChemData

Smile

CCC1=C(C=C(C(=C1)C)OCC2=C(C=CC=C2Cl)N(C(=O)NC)O)C

DOS

IR

Vibrations