Geometry & MOs

Info

ID:	206518
PubChem CID:	80263878
Reduced:	FON2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	308.135863
ΔH_f, kcal/mol:	-90.85
Dipole, Da:	3.62
IP(EA), eV:	-9.29(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-carbamothioyl-4-methylcyclohexyl)-2-fluoro-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NC2(CCCC2)CN)F

DOS

IR

Vibrations