Geometry & MOs

Info

ID:	235137
PubChem CID:	92304108
Reduced:	ON3H23C25 (1)
Stoich.:	AB3C23D25 (1)
Weight, g/mol:	387.158292
ΔH_f, kcal/mol:	73.67
Dipole, Da:	5.02
IP(EA), eV:	-8.41(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2-hydroxyphenyl)-3-[(E)-1-(4-methoxyphenyl)ethylideneamino]-1,2-dihydroquinazolin-4-one

Drug info:

PubChemData

Smile

C/C(=C/C1=CC=CC=C1)/C=N\NC(=O)CCN2C3=CC=CC=C3C4=CC=CC=C42

DOS

IR

Vibrations