Geometry & MOs

Info

ID:	187994
PubChem CID:	77652233
Reduced:	ON3C24H45 (1)
Stoich.:	AB3C24D45 (1)
Weight, g/mol:	391.356263
ΔH_f, kcal/mol:	-92.22
Dipole, Da:	1.83
IP(EA), eV:	-8.72(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-[(1-amino-4,5-dipropyloctan-4-yl)amino]-4-phenylbutan-2-ol

Drug info:

PubChemData

Smile

CCCC(CCC)NC(CC)CCCCNCC(C(CC1=CC=CC=C1)N)O

DOS

IR

Vibrations