Geometry & MOs

Info

ID:	220753
PubChem CID:	85238699
Reduced:	NO4C6H11 (1)
Stoich.:	AB4C6D11 (1)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-139.43
Dipole, Da:	1.97
IP(EA), eV:	-10.05(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-5-methyl-1-propan-2-ylcyclopent-2-en-1-ol

Drug info:

PubChemData

Smile

C1C(ON=C1CO)C(CO)O

DOS

IR

Vibrations