Geometry & MOs

Info

ID:	145813
PubChem CID:	53598235
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	343.161995
ΔH_f, kcal/mol:	-47.48
Dipole, Da:	7.44
IP(EA), eV:	-8.81(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CCN1CCN(C1=O)C2CCN(CC2)CC3=C(ON=C3C)C

DOS

IR

Vibrations