Geometry & MOs

Info

ID:	150066
PubChem CID:	53789751
Reduced:	NO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	301.184193
ΔH_f, kcal/mol:	-87.99
Dipole, Da:	7.51
IP(EA), eV:	-10.48(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-5-(3-methoxy-3-methylbutyl)-N-(4-methylphenyl)aniline

Drug info:

PubChemData

Smile

CC1([C@@H]([C@H](C2=C1C=CC(=C2)[N+](=O)[O-])O)O)C

DOS

IR

Vibrations