Geometry & MOs

Info

ID:	224409
PubChem CID:	85342607
Reduced:	O3C28H38 (1)
Stoich.:	A3B28C38 (1)
Weight, g/mol:	303.170868
ΔH_f, kcal/mol:	-122.53
Dipole, Da:	1.8
IP(EA), eV:	-9.2(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CCC23CC1C(C2CCC3COCC4=CC=CC=C4)(C)CCC=C(C)C(=O)OC

DOS

IR

Vibrations