Geometry & MOs

Info

ID:	25995
PubChem CID:	635330
Reduced:	NC34H47 (1)
Stoich.:	AB34C47 (1)
Weight, g/mol:	470.358007
ΔH_f, kcal/mol:	45.59
Dipole, Da:	1.16
IP(EA), eV:	-7.82(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tripropyl-[(6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-yl)oxy]silane

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2C=CC4=CC5=C(CC34C)C6=CC=CC=C6N5C)C

DOS

IR

Vibrations