Geometry & MOs

Info

ID:	441957
PubChem CID:	135247115
Reduced:	NSO2C11H23 (1)
Stoich.:	ABC2D11E23 (1)
Weight, g/mol:	666.278347
ΔH_f, kcal/mol:	-83.91
Dipole, Da:	3.41
IP(EA), eV:	-7.12(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[4-[1-[(4,6-diphenyl-1,3,5-triazin-2-yl)methyl]naphthalen-2-yl]phenyl]-9,9-dimethylfluorene-2-carbonitrile

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCN(C1)S(C)(C)C

DOS

IR

Vibrations