Geometry & MOs

Info

ID:	120636
PubChem CID:	50738126
Reduced:	O5N6C35H48 (1)
Stoich.:	A5B6C35D48 (1)
Weight, g/mol:	589.245582
ΔH_f, kcal/mol:	-224.61
Dipole, Da:	3.3
IP(EA), eV:	-8.75(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-benzamido-4-chlorophenyl)-1-[1-oxo-1-[2-(propylcarbamoyl)anilino]propan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)C2=CC=CC=C2NC(=O)CN3CCC(CC3)C(=O)NC(C)C(=O)NC4=CC=CC(=C4C)C(=O)NC(C)C

DOS

IR

Vibrations