Geometry & MOs

Info

ID:	437663
PubChem CID:	135226770
Reduced:	SO4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	312.193674
ΔH_f, kcal/mol:	-184.28
Dipole, Da:	3.34
IP(EA), eV:	-9.3(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methyl-5-[(2-methylpropan-2-yl)oxy]-2-(2-methylprop-2-enoyloxy)cyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC1(CCCCC1C(=O)SC)CCOC

DOS

IR

Vibrations