Geometry & MOs

Info

ID:	312274
PubChem CID:	126604045
Reduced:	N2O2F3H27C29 (1)
Stoich.:	A2B2C3D27E29 (1)
Weight, g/mol:	498.288243
ΔH_f, kcal/mol:	-187.35
Dipole, Da:	4.73
IP(EA), eV:	-8.48(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-tert-butylphenyl)-2-(4-methoxyphenyl)-N-methyl-1-(2-methylbenzoyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(C(N(C1)C(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3)C(=O)NC4=CC5=C(CCC5)C=C4

DOS

IR

Vibrations