Geometry & MOs

Info

ID:	157664
PubChem CID:	56436364
Reduced:	SN3O4C17H25 (1)
Stoich.:	AB3C4D17E25 (1)
Weight, g/mol:	385.18017
ΔH_f, kcal/mol:	-169.84
Dipole, Da:	6.04
IP(EA), eV:	-8.44(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluorophenyl)-3-[[2-(4-methylpentanoylamino)acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CC(C)CCC(=O)NCC(=O)NC1=CC=C(C=C1)N2CCCS2(=O)=O

DOS

IR

Vibrations