Geometry & MOs

Info

ID:	308672
PubChem CID:	126522368
Reduced:	F3O4H11C17 (1)
Stoich.:	A3B4C11D17 (1)
Weight, g/mol:	248.108026
ΔH_f, kcal/mol:	-229.89
Dipole, Da:	4.26
IP(EA), eV:	-9.66(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-1H-indol-3-yl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC1=C(C(=C(C=C1)C2=C(C=C(C=C2)OC=O)F)F)F

DOS

IR

Vibrations