Geometry & MOs

Info

ID:	56522
PubChem CID:	17436069
Reduced:	ClSO3N5C19H20 (1)
Stoich.:	ABC3D5E19F20 (1)
Weight, g/mol:	432.075596
ΔH_f, kcal/mol:	-19.55
Dipole, Da:	2.16
IP(EA), eV:	-8.8(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(6,8-dichloro-4-oxoquinazolin-3-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC4CC4

DOS

IR

Vibrations