Geometry & MOs

Info

ID:	388113
PubChem CID:	134988193
Reduced:	NO2C15H29 (1)
Stoich.:	AB2C15D29 (1)
Weight, g/mol:	312.05863
ΔH_f, kcal/mol:	-144.61
Dipole, Da:	2.55
IP(EA), eV:	-9.88(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-iodobutyl)heptanoic acid

Drug info:

PubChemData

Smile

CCCCOC1CCCCCCCCCC(=O)N1

DOS

IR

Vibrations