Geometry & MOs

Info

ID:	111465
PubChem CID:	50369373
Reduced:	N5O6C31H39 (1)
Stoich.:	A5B6C31D39 (1)
Weight, g/mol:	575.310769
ΔH_f, kcal/mol:	-217.26
Dipole, Da:	6.79
IP(EA), eV:	-9.0(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopentylcarbamoyl)phenyl]-1-[2-[2-methyl-3-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N4CCOCC4)C(=O)N5CCOCC5

DOS

IR

Vibrations