Geometry & MOs

Info

ID:	110485
PubChem CID:	50326121
Reduced:	O4N5C26H33 (1)
Stoich.:	A4B5C26D33 (1)
Weight, g/mol:	522.259068
ΔH_f, kcal/mol:	-147.87
Dipole, Da:	3.55
IP(EA), eV:	-9.09(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-carbamoyl-2-methylanilino)-2-oxoethyl]-N-[2-[3-(dimethylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC(C)C3=CC=CC=C3)C(=O)N

DOS

IR

Vibrations