Geometry & MOs

Info

ID:	35951
PubChem CID:	7980536
Reduced:	N2O4H14C15 (1)
Stoich.:	A2B4C14D15 (1)
Weight, g/mol:	333.065735
ΔH_f, kcal/mol:	-111.59
Dipole, Da:	1.64
IP(EA), eV:	-9.32(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-dithiolan-2-yl)-N-(4-fluoro-2-methylphenyl)benzamide

Drug info:

PubChemData

Smile

CC(=O)NNC(=O)COC(=O)C1=CC2=CC=CC=C2C=C1

DOS

IR

Vibrations