Geometry & MOs

Info

ID:	386496
PubChem CID:	134981931
Reduced:	O3C13H20 (1)
Stoich.:	A3B13C20 (1)
Weight, g/mol:	151.1361
ΔH_f, kcal/mol:	-124.81
Dipole, Da:	5.1
IP(EA), eV:	-10.08(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC=C=C[C@@H]1[C@H](O[C@H](OC1=O)C(C)(C)C)C

DOS

IR

Vibrations