Geometry & MOs

Info

ID:	373788
PubChem CID:	131320079
Reduced:	ClNO2C12H16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	223.137242
ΔH_f, kcal/mol:	-82.88
Dipole, Da:	0.5
IP(EA), eV:	-9.2(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(R)-amino(cyclopentyl)methyl]-6-fluoro-4-methylphenol

Drug info:

PubChemData

Smile

C1COCCC1[C@@H](C2=C(C(=CC=C2)Cl)O)N

DOS

IR

Vibrations