Geometry & MOs

Info

ID:	9600
PubChem CID:	91360
Reduced:	NOC4H9 (3)
Stoich.:	ABC4D9 (3)
Weight, g/mol:	261.205242
ΔH_f, kcal/mol:	-149.6
Dipole, Da:	3.84
IP(EA), eV:	-8.88(1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3,5-bis(2-hydroxypropyl)-1,3,5-triazinan-1-yl]propan-2-ol

Drug info:

PubChemData

Smile

CC(CN1CN(CN(C1)CC(C)O)CC(C)O)O

DOS

IR

Vibrations