Geometry & MOs

Info

ID:	148479
PubChem CID:	53788141
Reduced:	NOC25H43 (1)
Stoich.:	ABC25D43 (1)
Weight, g/mol:	187.204848
ΔH_f, kcal/mol:	-70.43
Dipole, Da:	3.44
IP(EA), eV:	-9.42(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-hexylbutane-1,1,4-triamine

Drug info:

PubChemData

Smile

CCCCCC=CCC=CCC=CCC=CCCC(C)(C)C(=O)NCCC

DOS

IR

Vibrations