Geometry & MOs

Info

ID:	69480
PubChem CID:	47192276
Reduced:	ON2C16H24 (1)
Stoich.:	AB2C16D24 (1)
Weight, g/mol:	288.108562
ΔH_f, kcal/mol:	-55.91
Dipole, Da:	4.08
IP(EA), eV:	-8.38(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxolan-3-ylmethyl)-3-[2-(trifluoromethyl)phenyl]urea

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(=O)NC2=C(C=C(C=C2)C)C

DOS

IR

Vibrations