Geometry & MOs

Info

ID:	111125
PubChem CID:	50352964
Reduced:	N4O5C28H36 (1)
Stoich.:	A4B5C28D36 (1)
Weight, g/mol:	504.234825
ΔH_f, kcal/mol:	-189.81
Dipole, Da:	5.85
IP(EA), eV:	-8.48(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-methyl-3-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl]-N-(2,3,4-trifluorophenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CN2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCCO4)C(=O)NCC(C)C

DOS

IR

Vibrations