Geometry & MOs

Info

ID:	148057
PubChem CID:	53787719
Reduced:	O4H26C27 (2)
Stoich.:	A4B26C27 (2)
Weight, g/mol:	269.283098
ΔH_f, kcal/mol:	-217.57
Dipole, Da:	4.11
IP(EA), eV:	-8.59(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(dibutylamino)propyl]piperidin-4-amine

Drug info:

PubChemData

Smile

CC(=O)OCCOC1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC=C(C=C5)OCCOC(=O)OC6=CC7=C(C=C6)C(CC78CC(C9=C8C=C(C=C9)OC)(C)C)(C)C

DOS

IR

Vibrations