Geometry & MOs

Info

ID:	10041
PubChem CID:	96557
Reduced:	ClON2C13H13 (1)
Stoich.:	ABC2D13E13 (1)
Weight, g/mol:	248.071641
ΔH_f, kcal/mol:	-16.74
Dipole, Da:	1.85
IP(EA), eV:	-8.53(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloroethyl)-3-naphthalen-1-ylurea

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2NC(=O)NCCCl

DOS

IR

Vibrations