Geometry & MOs

Info

ID:	278719
PubChem CID:	103837215
Reduced:	ON2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	274.129298
ΔH_f, kcal/mol:	-36.59
Dipole, Da:	3.24
IP(EA), eV:	-9.62(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-(5,5,5-trifluoropentyl)urea

Drug info:

PubChemData

Smile

CCCCNC(=O)NCC1(CC1)C2CC2

DOS

IR

Vibrations