Geometry & MOs

Info

ID:	286131
PubChem CID:	104153366
Reduced:	ON3C16H29 (1)
Stoich.:	AB3C16D29 (1)
Weight, g/mol:	259.204848
ΔH_f, kcal/mol:	-45.56
Dipole, Da:	2.21
IP(EA), eV:	-8.31(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-6-propan-2-yl-4-(propylaminomethyl)-N-prop-2-ynylpyridin-2-amine

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)CNC)N(CC)CCOCC

DOS

IR

Vibrations