Geometry & MOs

Info

ID:	198700
PubChem CID:	79138422
Reduced:	FNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	251.168543
ΔH_f, kcal/mol:	-92.94
Dipole, Da:	3.38
IP(EA), eV:	-9.43(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(aminomethyl)cycloheptyl]-(2-fluorophenyl)methanol

Drug info:

PubChemData

Smile

CC1CCC(C1)(CN)C(C2=CC=CC=C2F)O

DOS

IR

Vibrations