Geometry & MOs

Info

ID:	52560
PubChem CID:	12015478
Reduced:	O2C7H9 (4)
Stoich.:	A2B7C9 (4)
Weight, g/mol:	444.178418
ΔH_f, kcal/mol:	-297.68
Dipole, Da:	2.6
IP(EA), eV:	-9.2(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=C2[C@@H](CC13C(=O)OC(OC3=O)(C)C)[C@@]4(C(=C(C)C)[C@H](C2(C)C)CC45C(=O)OC(OC5=O)(C)C)C

DOS

IR

Vibrations