Geometry & MOs

Info

ID:	442846
PubChem CID:	135256605
Reduced:	NOSC16H33 (1)
Stoich.:	ABCD16E33 (1)
Weight, g/mol:	158.153147
ΔH_f, kcal/mol:	-123.38
Dipole, Da:	3.92
IP(EA), eV:	-9.05(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-4-aminobutylideneamino]propane-1,3-diamine

Drug info:

PubChemData

Smile

CCCCCCCCCCCNC(=O)CC(C)(C)S

DOS

IR

Vibrations