Geometry & MOs

Info

ID:	262572
PubChem CID:	103301762
Reduced:	NF4H11C14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	271.154784
ΔH_f, kcal/mol:	-146.66
Dipole, Da:	1.85
IP(EA), eV:	-9.74(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cycloheptyl-1-(2,4,5-trifluorophenyl)ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)C(C2=CC(=C(C=C2F)F)F)N

DOS

IR

Vibrations