Geometry & MOs

Info

ID:	199521
PubChem CID:	79259633
Reduced:	ON5C9H15 (1)
Stoich.:	AB5C9D15 (1)
Weight, g/mol:	286.15037
ΔH_f, kcal/mol:	4.18
Dipole, Da:	4.34
IP(EA), eV:	-9.24(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylphenyl)methylsulfanylmethyl]-N-propylpyridin-4-amine

Drug info:

PubChemData

Smile

CN(CC1=NC=CC(=C1)NN)CC(=O)N

DOS

IR

Vibrations