Geometry & MOs

Info

ID:	95324
PubChem CID:	50008268
Reduced:	O5N6C28H36 (1)
Stoich.:	A5B6C28D36 (1)
Weight, g/mol:	564.306018
ΔH_f, kcal/mol:	-187.91
Dipole, Da:	6.47
IP(EA), eV:	-8.95(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(diethylcarbamoyl)anilino]-2-oxoethyl]-1-[2-[2-methyl-5-(methylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=CC=CC(=C3C)C(=O)NC

DOS

IR

Vibrations