Geometry & MOs

Info

ID:	4434
PubChem CID:	11402
Reduced:	FNOC12H18 (1)
Stoich.:	ABCD12E18 (1)
Weight, g/mol:	211.137242
ΔH_f, kcal/mol:	-94.61
Dipole, Da:	4.78
IP(EA), eV:	-9.36(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(tert-butylamino)-1-(3-fluorophenyl)ethanol

Drug info:

PubChemData

Smile

CC(C)(C)NCC(C1=CC(=CC=C1)F)O

DOS

IR

Vibrations