Geometry & MOs

Info

ID:	31191
PubChem CID:	855067
Reduced:	Cl2O2N3C11H13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	330.136828
ΔH_f, kcal/mol:	-61.48
Dipole, Da:	5.82
IP(EA), eV:	-8.95(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(3-phenylmethoxyphenyl)-2,3-dihydro-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

C1COCCN1NC(=O)NC2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations