Geometry & MOs

Info

ID:	158964
PubChem CID:	57244307
Reduced:	FN3O3C22H26 (1)
Stoich.:	AB3C3D22E26 (1)
Weight, g/mol:	159.137162
ΔH_f, kcal/mol:	-135.74
Dipole, Da:	4.74
IP(EA), eV:	-8.65(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(4-aminobutyl)propanamide

Drug info:

PubChemData

Smile

CC1C(=NC2=C(O1)C=CC(=C2)C(C(=O)OC(C)(C)CCC3=CC=CC=C3F)N)N

DOS

IR

Vibrations