Geometry & MOs

Info

ID:	153493
PubChem CID:	56312723
Reduced:	FO2N3C24H30 (1)
Stoich.:	AB2C3D24E30 (1)
Weight, g/mol:	432.187206
ΔH_f, kcal/mol:	-61.5
Dipole, Da:	4.45
IP(EA), eV:	-8.61(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[1-[3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]propanoyl]piperidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CN(CCN(C)C(=O)/C=C/C1=CC(=C(C=C1)OC2=CN=CC=C2)F)C3CCCCC3

DOS

IR

Vibrations