Geometry & MOs

Info

ID:	374012
PubChem CID:	131322344
Reduced:	FN2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	178.146999
ΔH_f, kcal/mol:	-39.05
Dipole, Da:	3.44
IP(EA), eV:	-9.6(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-3-methyl-1-(4-methylpyridin-3-yl)butan-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@H](C2=NC(=CC=C2)F)N

DOS

IR

Vibrations