Geometry & MOs

Info

ID:	433052
PubChem CID:	135173189
Reduced:	NC13H25 (1)
Stoich.:	AB13C25 (1)
Weight, g/mol:	553.251798
ΔH_f, kcal/mol:	-49.45
Dipole, Da:	1.88
IP(EA), eV:	-9.17(3.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexa-1,5-dien-1-yl-4-phenyl-6-(9-phenyl-9-pyridin-2-yl-4b,8a-dihydrofluoren-2-yl)pyrimidine

Drug info:

PubChemData

Smile

CCC1(CC2(CCCC(C2)(C1)N)C)C

DOS

IR

Vibrations