Geometry & MOs

Info

ID:	222269
PubChem CID:	85295847
Reduced:	OC4H7 (4)
Stoich.:	AB4C7 (4)
Weight, g/mol:	288.245316
ΔH_f, kcal/mol:	-215.78
Dipole, Da:	4.88
IP(EA), eV:	-9.83(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,10,10b-hexahydro-1H-benzo[f]chromene

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)CC1COC(C1C(=O)C(C)(C)C)CO

DOS

IR

Vibrations