Geometry & MOs

Info

ID:	155622
PubChem CID:	56366373
Reduced:	SN2O4C22H28 (1)
Stoich.:	AB2C4D22E28 (1)
Weight, g/mol:	381.186398
ΔH_f, kcal/mol:	-134.47
Dipole, Da:	6.61
IP(EA), eV:	-8.97(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(butanoylamino)piperidin-1-yl]-3-oxopropyl]-2,4-difluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC(C)C(=O)NCC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

DOS

IR

Vibrations