Geometry & MOs

Info

ID:	85011
PubChem CID:	49871299
Reduced:	ClPN2H22C31 (1)
Stoich.:	ABC2D22E31 (1)
Weight, g/mol:	334.087291
ΔH_f, kcal/mol:	126.15
Dipole, Da:	3.77
IP(EA), eV:	-8.13(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-4-(2-methoxynaphthalen-1-yl)-2-methylquinazoline

Drug info:

PubChemData

Smile

CC1=NC2=C(C=CC(=C2)Cl)C(=N1)C3=C(C=CC4=CC=CC=C43)P(C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations