Geometry & MOs

Info

ID:	233546
PubChem CID:	91145414
Reduced:	ClO2N4H15C20 (1)
Stoich.:	AB2C4D15E20 (1)
Weight, g/mol:	307.084242
ΔH_f, kcal/mol:	53.59
Dipole, Da:	4.5
IP(EA), eV:	-8.89(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-difluoro-4-methylidenecyclohexyl)-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CON1C(=O)C=CC2=C(N=C(N=C21)NC3=CC=CC=C3)C4=CC=CC=C4Cl

DOS

IR

Vibrations