Geometry & MOs

Info

ID:	310956
PubChem CID:	126588600
Reduced:	ClNSO2C18H20 (1)
Stoich.:	ABCD2E18F20 (1)
Weight, g/mol:	340.215078
ΔH_f, kcal/mol:	-66.75
Dipole, Da:	5.2
IP(EA), eV:	-9.03(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(4-ethyl-2-methylphenoxy)methyl]-5-propan-2-ylphenyl]-3-methylurea

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=C(C=C2)Cl)NC(=O)SC)C

DOS

IR

Vibrations