Geometry & MOs

Info

ID:	319987
PubChem CID:	126657740
Reduced:	NC20H41 (1)
Stoich.:	AB20C41 (1)
Weight, g/mol:	222.198365
ΔH_f, kcal/mol:	-83.02
Dipole, Da:	1.94
IP(EA), eV:	-8.61(3.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-[(2S)-6-methylhept-5-en-2-yl]cyclohex-3-en-1-ol

Drug info:

PubChemData

Smile

CCCCCCC(CCCCCC)C1CCCCCNC1

DOS

IR

Vibrations