Geometry & MOs

Info

ID:	31188
PubChem CID:	855060
Reduced:	ClON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	338.235814
ΔH_f, kcal/mol:	-56.96
Dipole, Da:	5.72
IP(EA), eV:	-8.75(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,6-di(propan-2-yl)phenyl]-3-(4-propan-2-ylphenyl)urea

Drug info:

PubChemData

Smile

C1CCCC(CCC1)NC(=O)NC2=CC=C(C=C2)Cl

DOS

IR

Vibrations