Geometry & MOs

Info

ID:	144706
PubChem CID:	53400619
Reduced:	NO9C26H31 (1)
Stoich.:	AB9C26D31 (1)
Weight, g/mol:	258.25588
ΔH_f, kcal/mol:	-275.63
Dipole, Da:	5.86
IP(EA), eV:	-8.58(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexadecane-1,15-diol

Drug info:

PubChemData

Smile

CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N(C)C.C(=CC(=O)[O-])C(=O)[O-]

DOS

IR

Vibrations