Geometry & MOs

Info

ID:	9153
PubChem CID:	86669
Reduced:	NOC4H9 (4)
Stoich.:	ABC4D9 (4)
Weight, g/mol:	348.273656
ΔH_f, kcal/mol:	-79.33
Dipole, Da:	5.2
IP(EA), eV:	-3.38(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

2-hydroxypropyl-[[6-[[2-hydroxypropyl(dimethyl)azaniumyl]amino]-6-oxohexanoyl]amino]-dimethylazanium

Drug info:

PubChemData

Smile

CC(C[N+](C)(C)NC(=O)CCCCC(=O)N[N+](C)(C)CC(C)O)O

DOS

IR

Vibrations