Geometry & MOs

Info

ID:	201812
PubChem CID:	79587014
Reduced:	FNO2C17H26 (1)
Stoich.:	ABC2D17E26 (1)
Weight, g/mol:	309.17625
ΔH_f, kcal/mol:	-139.51
Dipole, Da:	3.75
IP(EA), eV:	-9.2(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[2-[(2-methylphenyl)methylsulfonyl]ethyl]cyclopentan-1-amine

Drug info:

PubChemData

Smile

CCCNC1(CCCC1CCOC2=CC(=CC=C2)F)CO

DOS

IR

Vibrations