Geometry & MOs

Info

ID:	157788
PubChem CID:	56437241
Reduced:	FO3N4C19H25 (1)
Stoich.:	AB3C4D19E25 (1)
Weight, g/mol:	410.231791
ΔH_f, kcal/mol:	-135.44
Dipole, Da:	4.0
IP(EA), eV:	-9.47(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-oxo-2-[1-[4-(phenylcarbamoylamino)phenyl]ethylamino]ethyl]pentanamide

Drug info:

PubChemData

Smile

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)N(C)CCCC(=O)OC(C)(C)C

DOS

IR

Vibrations