Geometry & MOs

Info

ID:	95897
PubChem CID:	50016474
Reduced:	O4N5C35H43 (1)
Stoich.:	A4B5C35D43 (1)
Weight, g/mol:	507.284555
ΔH_f, kcal/mol:	-137.79
Dipole, Da:	7.73
IP(EA), eV:	-8.59(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-carbamoyl-6-methylphenyl)-1-[2-[5-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)C)NC(=O)C(C)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CC(=C4)C

DOS

IR

Vibrations