Geometry & MOs

Info

ID:	134831
PubChem CID:	51765883
Reduced:	FO2N3C29H40 (1)
Stoich.:	AB2C3D29E40 (1)
Weight, g/mol:	481.310456
ΔH_f, kcal/mol:	-125.0
Dipole, Da:	6.13
IP(EA), eV:	-8.08(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(cyclohexylamino)-1-[4-(dimethylamino)phenyl]-2-oxoethyl]-4-fluoro-N-hexylbenzamide

Drug info:

PubChemData

Smile

CCCCCCN([C@@H](C1=CC=C(C=C1)N(C)C)C(=O)NC2CCCCC2)C(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations