Geometry & MOs

Info

ID:	320901
PubChem CID:	126664222
Reduced:	IN2O2C14H23 (1)
Stoich.:	AB2C2D14E23 (1)
Weight, g/mol:	366.10558
ΔH_f, kcal/mol:	-15.11
Dipole, Da:	2.48
IP(EA), eV:	-9.69(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-pentylcyclopentyl) 2-iodo-2-methylbutanoate

Drug info:

PubChemData

Smile

CC(C)(C)C1(CCCC1)OC(=O)C(C)(C23C(N2)N3)I

DOS

IR

Vibrations