Geometry & MOs

Info

ID:	314471
PubChem CID:	126621879
Reduced:	ClN3H14C21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	442.123676
ΔH_f, kcal/mol:	116.13
Dipole, Da:	3.35
IP(EA), eV:	-8.26(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-(3,5-diphenylphenyl)benzo[h]quinazoline

Drug info:

PubChemData

Smile

C1C(=CC=CN1)C2=NC(=NC3=C2C4=CC=CC=C4C5=CC=CC=C53)Cl

DOS

IR

Vibrations