Geometry & MOs

Info

ID:	10953
PubChem CID:	109382
Reduced:	O3C8H16 (1)
Stoich.:	A3B8C16 (1)
Weight, g/mol:	160.109944
ΔH_f, kcal/mol:	-158.6
Dipole, Da:	2.36
IP(EA), eV:	-10.44(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxyheptyl formate

Drug info:

PubChemData

Smile

CCCCCC(COC=O)O

DOS

IR

Vibrations