Geometry & MOs

Info

ID:	218060
PubChem CID:	85088806
Reduced:	SiO3C26H36 (1)
Stoich.:	AB3C26D36 (1)
Weight, g/mol:	424.370516
ΔH_f, kcal/mol:	-147.54
Dipole, Da:	4.33
IP(EA), eV:	-8.96(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3a,5a,7a,8,11b,13a-hexamethyl-3-propan-2-yl-2,3,4,5,5b,6,7,11,11a,12,13,13b-dodecahydro-1H-cyclopenta[a]chrysen-10-one

Drug info:

PubChemData

Smile

CC1(C=CCO1)C(CCCCO[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)O

DOS

IR

Vibrations