Geometry & MOs

Info

ID:	198699
PubChem CID:	79138367
Reduced:	NO2C15H25 (1)
Stoich.:	AB2C15D25 (1)
Weight, g/mol:	237.152892
ΔH_f, kcal/mol:	-96.96
Dipole, Da:	1.53
IP(EA), eV:	-9.11(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(aminomethyl)-3-methylcyclopentyl]-(2-fluorophenyl)methanol

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(C2(CCCC(C2)C)CN)O

DOS

IR

Vibrations