Geometry & MOs

Info

ID:	328833
PubChem CID:	126728331
Reduced:	SO4N5C20H29 (1)
Stoich.:	AB4C5D20E29 (1)
Weight, g/mol:	283.173628
ΔH_f, kcal/mol:	-132.24
Dipole, Da:	4.33
IP(EA), eV:	-9.03(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluoro-2-phenylphenyl)methyl]cyclohexanamine

Drug info:

PubChemData

Smile

COCCOCCNCC1CCC(CC1)NC2=NC=CC(=N2)/C=C\3/C(=O)NC(=O)S3

DOS

IR

Vibrations