Geometry & MOs

Info

ID:	177252
PubChem CID:	76154479
Reduced:	ClFN4O9C33H38 (1)
Stoich.:	ABC4D9E33F38 (1)
Weight, g/mol:	418.167477
ΔH_f, kcal/mol:	-374.05
Dipole, Da:	6.03
IP(EA), eV:	-8.8(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-2-(4-cyclopropylsulfonyl-2-oxopyridin-1-yl)-N-(1-methylpyrazol-3-yl)propanamide

Drug info:

PubChemData

Smile

C1CN(C(=O)N1)CCCN2CCN(CC2)C3CC(C4=C3C=CC(=C4)Cl)C5=CC=C(C=C5)F.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

DOS

IR

Vibrations