Geometry & MOs

Info

ID:	130214
PubChem CID:	51075290
Reduced:	O3N4C15H24 (1)
Stoich.:	A3B4C15D24 (1)
Weight, g/mol:	311.124547
ΔH_f, kcal/mol:	-108.5
Dipole, Da:	7.7
IP(EA), eV:	-9.2(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-imidazol-1-ylpropyl)-2-[4-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)C1CCCN(C1)C(=O)N)C2=CC=CO2

DOS

IR

Vibrations