Geometry & MOs

Info

ID:	153590
PubChem CID:	56312845
Reduced:	FO2N5H22C25 (1)
Stoich.:	AB2C5D22E25 (1)
Weight, g/mol:	430.244327
ΔH_f, kcal/mol:	13.84
Dipole, Da:	6.92
IP(EA), eV:	-8.66(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclohexyl(methyl)amino]ethyl]-3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NN1)C2=CC=CC=C2NC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations