Geometry & MOs

Info

ID:	28203
PubChem CID:	826254
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	222.055991
ΔH_f, kcal/mol:	-71.03
Dipole, Da:	7.63
IP(EA), eV:	-8.6(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-4-ethoxy-2-methylquinazoline

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C=C(C=C2)CC(=O)O)C

DOS

IR

Vibrations