Geometry & MOs

Info

ID:	130243
PubChem CID:	51075360
Reduced:	N3O4C18H23 (1)
Stoich.:	A3B4C18D23 (1)
Weight, g/mol:	249.134049
ΔH_f, kcal/mol:	-112.18
Dipole, Da:	5.79
IP(EA), eV:	-8.39(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(trifluoromethyl)cyclohexyl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CN1C(=O)CCC(=N1)C(=O)N2CCCC2C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations