Geometry & MOs

Info

ID:	220443
PubChem CID:	85195375
Reduced:	C8H11 (2)
Stoich.:	A8B11 (2)
Weight, g/mol:	215.115758
ΔH_f, kcal/mol:	10.2
Dipole, Da:	0.89
IP(EA), eV:	-8.5(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(hydroxymethyl)-8-oxoazocane-2-carboxylate

Drug info:

PubChemData

Smile

C1CC2CCC3=CC=C(CCC(C1)C2)C=C3

DOS

IR

Vibrations