Geometry & MOs

Info

ID:	261043
PubChem CID:	103215394
Reduced:	ClINC15H21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	295.212299
ΔH_f, kcal/mol:	16.59
Dipole, Da:	2.91
IP(EA), eV:	-9.23(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-ethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC1CCC1)C2=CC(=C(C=C2)I)Cl

DOS

IR

Vibrations