Geometry & MOs

Info

ID:	200921
PubChem CID:	79462169
Reduced:	N2O2F3C13H23 (1)
Stoich.:	A2B2C3D13E23 (1)
Weight, g/mol:	233.189198
ΔH_f, kcal/mol:	-300.73
Dipole, Da:	3.56
IP(EA), eV:	-9.55(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-[2-[(dimethylamino)methyl]phenyl]cyclopentane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCC(C1)NCCC(F)(F)F

DOS

IR

Vibrations