Geometry & MOs

Info

ID:	70544
PubChem CID:	48413491
Reduced:	SN3O3C18H31 (1)
Stoich.:	AB3C3D18E31 (1)
Weight, g/mol:	337.216555
ΔH_f, kcal/mol:	-130.57
Dipole, Da:	3.92
IP(EA), eV:	-8.63(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[5-(diethylamino)pentan-2-ylamino]-2-oxoethyl]-4-fluorobenzamide

Drug info:

PubChemData

Smile

CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NC(C)CCCN(CC)CC

DOS

IR

Vibrations