Geometry & MOs

Info

ID:	205871
PubChem CID:	80168663
Reduced:	FNOSC15H22 (1)
Stoich.:	ABCDE15F22 (1)
Weight, g/mol:	279.199843
ΔH_f, kcal/mol:	-102.97
Dipole, Da:	1.93
IP(EA), eV:	-8.54(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-[cyclopropyl(3-methylbutyl)amino]-5-fluoro-4-methylphenyl]ethanol

Drug info:

PubChemData

Smile

CC1CN(CC(S1)C)C2=C(C=C(C(=C2)C)F)[C@H](C)O

DOS

IR

Vibrations