Geometry & MOs

Info

ID:	130951
PubChem CID:	51133994
Reduced:	ClON3C17H22 (1)
Stoich.:	ABC3D17E22 (1)
Weight, g/mol:	298.148141
ΔH_f, kcal/mol:	39.8
Dipole, Da:	1.36
IP(EA), eV:	-9.48(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-3-(1-methyl-3,4-dihydro-2H-naphthalen-1-yl)urea

Drug info:

PubChemData

Smile

CCC(CC)(C1=CC=C(C=C1)Cl)NCC2=NC(=NO2)C3CC3

DOS

IR

Vibrations