Geometry & MOs

Info

ID:	326255
PubChem CID:	126687241
Reduced:	ClC10H19 (1)
Stoich.:	AB10C19 (1)
Weight, g/mol:	299.187674
ΔH_f, kcal/mol:	-45.15
Dipole, Da:	2.64
IP(EA), eV:	-8.97(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-2-[(E)-[(Z)-2-[2-(4-aminobutan-2-ylimino)ethyl]but-2-enylidene]amino]-2-chloroethenyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCC(=C(C)C)[C@@H](C)CCCl

DOS

IR

Vibrations