Geometry & MOs

Info

ID:	288907
PubChem CID:	104328059
Reduced:	FN3C13H16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	291.145699
ΔH_f, kcal/mol:	-6.83
Dipole, Da:	3.74
IP(EA), eV:	-9.06(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-tert-butylthiophen-2-yl)-1-(4-fluoro-2-methylphenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(CC2=NC=CN2)NC

DOS

IR

Vibrations