Geometry & MOs

Info

ID:	282150
PubChem CID:	103917332
Reduced:	NOF2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	308.138091
ΔH_f, kcal/mol:	-117.59
Dipole, Da:	2.76
IP(EA), eV:	-9.29(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(dithiophen-2-ylmethyl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CCOC1CC(C1)NCC2=CC(=CC(=C2)F)F

DOS

IR

Vibrations