Geometry & MOs

Info

ID:	2630
PubChem CID:	8094
Reduced:	O2C7H14 (1)
Stoich.:	A2B7C14 (1)
Weight, g/mol:	130.09938
ΔH_f, kcal/mol:	-118.44
Dipole, Da:	4.53
IP(EA), eV:	-10.93(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptanoic acid

Drug info:

PubChemData

Smile

CCCCCCC(=O)O

DOS

IR

Vibrations