Geometry & MOs

Info

ID:	202499
PubChem CID:	79679358
Reduced:	NOC17H25 (1)
Stoich.:	ABC17D25 (1)
Weight, g/mol:	267.179856
ΔH_f, kcal/mol:	-18.29
Dipole, Da:	3.48
IP(EA), eV:	-8.52(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(3,5-difluorophenyl)-2-methylcyclopentyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC1CCCC1(CNC2CC2)C3=CC(=CC=C3)OC

DOS

IR

Vibrations