Geometry & MOs

Info

ID:	441836
PubChem CID:	135245652
Reduced:	N5H29C40 (1)
Stoich.:	A5B29C40 (1)
Weight, g/mol:	372.162649
ΔH_f, kcal/mol:	254.85
Dipole, Da:	3.84
IP(EA), eV:	-8.89(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylnaphthalen-1-yl)-4,6-diphenylpyrimidine

Drug info:

PubChemData

Smile

C/C(=C\C=C/C=C)/C1=NN=C(C=C1)C2=C(C3=CC=CC=C3C4=CC=CC=C42)C5=NC(=NC(=N5)C6=CC=CC=C6)C7=CC=CC=C7

DOS

IR

Vibrations