Geometry & MOs

Info

ID:	427245
PubChem CID:	135156407
Reduced:	ON3C23H29 (1)
Stoich.:	AB3C23D29 (1)
Weight, g/mol:	216.172545
ΔH_f, kcal/mol:	-6.15
Dipole, Da:	6.31
IP(EA), eV:	-8.43(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 2-ethylhexaneperoxoate

Drug info:

PubChemData

Smile

CC(=CC1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)C

DOS

IR

Vibrations