Geometry & MOs

Info

ID:	147809
PubChem CID:	53787467
Reduced:	N3C19H31 (1)
Stoich.:	A3B19C31 (1)
Weight, g/mol:	572.283292
ΔH_f, kcal/mol:	8.41
Dipole, Da:	1.35
IP(EA), eV:	-8.41(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-[2,6-difluoro-4-[2-[4-[2-(4-heptylphenyl)ethyl]cyclohexyl]ethyl]phenyl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CNCC(C1=CC=CC=C1)N2CCC(CC2)N3CCCCC3

DOS

IR

Vibrations