Geometry & MOs

Info

ID:	203314
PubChem CID:	79812485
Reduced:	N2C13H28 (1)
Stoich.:	A2B13C28 (1)
Weight, g/mol:	213.129969
ΔH_f, kcal/mol:	-46.45
Dipole, Da:	0.51
IP(EA), eV:	-8.78(3.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-1-N-(1,3-thiazol-4-ylmethyl)butane-1,2-diamine

Drug info:

PubChemData

Smile

CCC(CC)(CNCC1(CCCC1)C)N

DOS

IR

Vibrations