Geometry & MOs

Info

ID:	441969
PubChem CID:	135247227
Reduced:	NOSC8H13 (1)
Stoich.:	ABCD8E13 (1)
Weight, g/mol:	668.293997
ΔH_f, kcal/mol:	-5.65
Dipole, Da:	3.0
IP(EA), eV:	-8.38(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(N(S(=O)C1)C)C=C

DOS

IR

Vibrations