Geometry & MOs

Info

ID:	94808
PubChem CID:	50004002
Reduced:	N2O2C14H19 (2)
Stoich.:	A2B2C14D19 (2)
Weight, g/mol:	506.289306
ΔH_f, kcal/mol:	-157.86
Dipole, Da:	9.19
IP(EA), eV:	-8.87(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetylphenyl)-1-[1-[5-(butan-2-ylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=CC(=C(C=C1)C)NC(=O)C(C)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)OC

DOS

IR

Vibrations