Geometry & MOs

Info

ID:	61704
PubChem CID:	26711968
Reduced:	SN2O5C21H22 (1)
Stoich.:	AB2C5D21E22 (1)
Weight, g/mol:	297.111341
ΔH_f, kcal/mol:	-122.25
Dipole, Da:	7.6
IP(EA), eV:	-8.64(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CO2)S(=O)(=O)NC3=CC=CC=C3OC

DOS

IR

Vibrations