Geometry & MOs

Info

ID:	219728
PubChem CID:	85164694
Reduced:	SiO4C36H50 (1)
Stoich.:	AB4C36D50 (1)
Weight, g/mol:	574.438596
ΔH_f, kcal/mol:	-199.9
Dipole, Da:	3.47
IP(EA), eV:	-8.89(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl) 3-(4-hydroxyphenyl)propanoate

Drug info:

PubChemData

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔH_f, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(S_z, S²):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

CC1C(OC(OC1C(C)CO[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)(C)C)C(C)COCC4=CC=CC=C4

DOS

IR

Vibrations

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔHf, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(Sz, S2):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

CC1C(OC(OC1C(C)CO[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)(C)C)C(C)COCC4=CC=CC=C4

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):