Geometry & MOs

Info

ID:	105259
PubChem CID:	50106772
Reduced:	F3N5O5C26H30 (1)
Stoich.:	A3B5C5D26E30 (1)
Weight, g/mol:	508.243418
ΔH_f, kcal/mol:	-348.23
Dipole, Da:	5.33
IP(EA), eV:	-9.15(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-carbamoylanilino)-3-oxopropyl]-1-[2-(4-carbamoyl-2-methylanilino)-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N)NC(=O)CN2CCC(CC2)C(=O)NCCC(=O)NC3=CC=CC=C3OC(F)(F)F

DOS

IR

Vibrations