Geometry & MOs

Info

ID:	290077
PubChem CID:	104406831
Reduced:	FN3C13H22 (1)
Stoich.:	AB3C13D22 (1)
Weight, g/mol:	244.19732
ΔH_f, kcal/mol:	-31.14
Dipole, Da:	2.82
IP(EA), eV:	-8.68(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,1-N-diethyl-2-N-[(2-methylthiolan-2-yl)methyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CC)CC(C)NCC1=C(C=NC=C1)F

DOS

IR

Vibrations