Geometry & MOs

Info

ID:	178339
PubChem CID:	76312044
Reduced:	F2O2S2N4H20C21 (1)
Stoich.:	A2B2C2D4E20F21 (1)
Weight, g/mol:	368.98386
ΔH_f, kcal/mol:	-115.53
Dipole, Da:	1.3
IP(EA), eV:	-9.02(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-chloro-2-[(2,4-dichlorophenoxy)methyl]quinazolin-4-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)NC(=S)NC3=CC(=CC(=C3)F)F)C

DOS

IR

Vibrations