Geometry & MOs

Info

ID:	206618
PubChem CID:	80274364
Reduced:	FNOC16H24 (1)
Stoich.:	ABCD16E24 (1)
Weight, g/mol:	297.149557
ΔH_f, kcal/mol:	-98.78
Dipole, Da:	3.31
IP(EA), eV:	-9.39(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-(5-chloro-2-methoxyphenyl)-1-(1-methylcyclopentyl)propan-1-ol

Drug info:

PubChemData

Smile

CCC1(CCCC1)C(C(CN)C2=CC=C(C=C2)F)O

DOS

IR

Vibrations