Geometry & MOs

Info

ID:	91965
PubChem CID:	49981000
Reduced:	N5O5C34H45 (1)
Stoich.:	A5B5C34D45 (1)
Weight, g/mol:	615.261232
ΔH_f, kcal/mol:	-197.92
Dipole, Da:	7.41
IP(EA), eV:	-8.91(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-benzamido-2-chlorophenyl)-1-[2-[5-(cyclopentylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2CCCC2)NC(=O)CN3CCC(CC3)C(=O)NC4=C(C=CC(=C4)C(=O)N5CCCCC5)OC

DOS

IR

Vibrations