Geometry & MOs

Info

ID:	284113
PubChem CID:	104037097
Reduced:	ON2C16H24 (1)
Stoich.:	AB2C16D24 (1)
Weight, g/mol:	224.13472
ΔH_f, kcal/mol:	-35.33
Dipole, Da:	2.69
IP(EA), eV:	-8.65(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butylsulfanyl-N-propylpyridin-2-amine

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(C2)OC3=CC(=NC=C3)NC)C)C

DOS

IR

Vibrations