Geometry & MOs

Info

ID:	375244
PubChem CID:	131481054
Reduced:	FN2O2C10H11 (1)
Stoich.:	AB2C2D10E11 (1)
Weight, g/mol:	225.092042
ΔH_f, kcal/mol:	-113.87
Dipole, Da:	2.57
IP(EA), eV:	-9.35(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[amino(cyclopentyl)methyl]-3-chlorophenol

Drug info:

PubChemData

Smile

CC1=C(C=CC2=C1NC(=O)[C@@]2(CO)N)F

DOS

IR

Vibrations