Geometry & MOs

Info

ID:	327282
PubChem CID:	126689399
Reduced:	SN4O5C21H24 (1)
Stoich.:	AB4C5D21E24 (1)
Weight, g/mol:	490.15222
ΔH_f, kcal/mol:	-55.2
Dipole, Da:	3.16
IP(EA), eV:	-9.4(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[7-(5-amino-5-methylhexa-1,3-diynyl)-4-oxoquinazolin-3-yl]-N-hydroxy-2-methyl-2-methylsulfonylbutanamide;formic acid

Drug info:

PubChemData

Smile

C[C@@](CCN1C=NC2=C(C1=O)C=CC(=C2)C#CC#CC(C)(C)N)(C(=O)NO)S(=O)(=O)C

DOS

IR

Vibrations