Geometry & MOs

Info

ID:	156700
PubChem CID:	56371782
Reduced:	ON6C25H28 (1)
Stoich.:	AB6C25D28 (1)
Weight, g/mol:	358.045125
ΔH_f, kcal/mol:	49.65
Dipole, Da:	0.49
IP(EA), eV:	-8.64(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(3,4-dichlorophenyl)ethyl]-3-[3-(difluoromethyl)phenyl]urea

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1C3CCCN3C(=O)NC4=CC=CC=C4N5C(=CC(=N5)C)C

DOS

IR

Vibrations