Geometry & MOs

Info

ID:	314079
PubChem CID:	126620343
Reduced:	ON4C17H20 (1)
Stoich.:	AB4C17D20 (1)
Weight, g/mol:	776.614118
ΔH_f, kcal/mol:	31.3
Dipole, Da:	3.36
IP(EA), eV:	-8.31(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

28-tert-butyl-3,25-diethyl-30-[[4-[hydroxy(methoxy)methyl]phenyl]methoxy]-25-propylbicyclo[24.3.1]triaconta-1(30),26,28-triene-3-carbothialdehyde

Drug info:

PubChemData

Smile

CC1C(=C)C2=C(N1)N=C(N=C2N(C)C3=CC=C(C=C3)OC)C

DOS

IR

Vibrations